3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid

C183H265N31O25 — CID 157282090

IUPAC3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid
SMILESCC(=O)CN1CCC(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1.CC(=O)CN1CCN(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1.CC(=O)CN1CCN(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1=O.CC(=O)CN1CCN(C(=O)NCCCCc2cnc3c(c2)CCCC3)CC1=O.O=C(O)CN1CCC(C(=O)CCCc2ccc3c(n2)CCCC3)CC1.O=C(O)CN1CCC(CCCCc2ccc3c(n2)CCCC3)CC1=O.O=C(O)CN1CCC(CN2CCC(Cc3ccc4c(n3)CCCC4)CC2)CC1.O=C(O)CN1CCN(C(=O)CCCc2ccc3c(n2)CCCC3)CC1.O=C(O)CN1CCN(C(=O)CCCc2ccc3c(n2)CCCC3)CC1=O
InChIInChI=1S/C23H35N3O2.C21H30N4O3.C21H32N4O2.C20H29N5O3.C20H31N5O2.2C20H28N2O3.C19H25N3O4.C19H27N3O3/c27-23(28)17-26-13-9-19(10-14-26)16-25-11-7-18(8-12-25)15-21-6-5-20-3-1-2-4-22(20)24-21;1-16(26)14-24-10-11-25(15-20(24)27)21(28)22-9-5-4-6-17-12-18-7-2-3-8-19(18)23-13-17;1-16(26)15-25-13-9-18(10-14-25)21(27)23-11-3-2-6-19-8-7-17-5-4-12-22-20(17)24-19;1-15(26)13-24-11-12-25(14-18(24)27)20(28)22-9-3-2-6-17-8-7-16-5-4-10-21-19(16)23-17;1-16(26)15-24-11-13-25(14-12-24)20(27)22-9-3-2-6-18-8-7-17-5-4-10-21-19(17)23-18;23-19-13-15(11-12-22(19)14-20(24)25)5-1-3-7-17-10-9-16-6-2-4-8-18(16)21-17;23-19(16-10-12-22(13-11-16)14-20(24)25)7-3-5-17-9-8-15-4-1-2-6-18(15)21-17;23-17(21-10-11-22(13-19(25)26)18(24)12-21)7-3-5-15-9-8-14-4-1-2-6-16(14)20-15;23-18(22-12-10-21(11-13-22)14-19(24)25)7-3-5-16-9-8-15-4-1-2-6-17(15)20-16/h5-6,18-19H,1-4,7-17H2,(H,27,28);12-13H,2-11,14-15H2,1H3,(H,22,28);7-8,18H,2-6,9-15H2,1H3,(H,22,24)(H,23,27);7-8H,2-6,9-14H2,1H3,(H,21,23)(H,22,28);7-8H,2-6,9-15H2,1H3,(H,21,23)(H,22,27);9-10,15H,1-8,11-14H2,(H,24,25);8-9,16H,1-7,10-14H2,(H,24,25);8-9H,1-7,10-13H2,(H,25,26);8-9H,1-7,10-14H2,(H,24,25)
InChIKeyAZTZCWXEFJXDFY-UHFFFAOYSA-N
MW3299.32 g/mol
LogP18.00
Rot. Bonds61

About 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid

3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid (PubChem CID 157282090) has the molecular formula C183H265N31O25 and a molecular weight of 3299.32 g/mol. Its IUPAC name is 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid.

Molecular Properties

Compound Name3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid
PubChem CID157282090
Molecular FormulaC183H265N31O25
Molecular Weight3299.32 g/mol
Exact Mass3297.04
IUPAC Name3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid
SMILESCC(=O)CN1CCC(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1.CC(=O)CN1CCN(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1.CC(=O)CN1CCN(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1=O.CC(=O)CN1CCN(C(=O)NCCCCc2cnc3c(c2)CCCC3)CC1=O.O=C(O)CN1CCC(C(=O)CCCc2ccc3c(n2)CCCC3)CC1.O=C(O)CN1CCC(CCCCc2ccc3c(n2)CCCC3)CC1=O.O=C(O)CN1CCC(CN2CCC(Cc3ccc4c(n3)CCCC4)CC2)CC1.O=C(O)CN1CCN(C(=O)CCCc2ccc3c(n2)CCCC3)CC1.O=C(O)CN1CCN(C(=O)CCCc2ccc3c(n2)CCCC3)CC1=O
InChIInChI=1S/C23H35N3O2.C21H30N4O3.C21H32N4O2.C20H29N5O3.C20H31N5O2.2C20H28N2O3.C19H25N3O4.C19H27N3O3/c27-23(28)17-26-13-9-19(10-14-26)16-25-11-7-18(8-12-25)15-21-6-5-20-3-1-2-4-22(20)24-21;1-16(26)14-24-10-11-25(15-20(24)27)21(28)22-9-5-4-6-17-12-18-7-2-3-8-19(18)23-13-17;1-16(26)15-25-13-9-18(10-14-25)21(27)23-11-3-2-6-19-8-7-17-5-4-12-22-20(17)24-19;1-15(26)13-24-11-12-25(14-18(24)27)20(28)22-9-3-2-6-17-8-7-16-5-4-10-21-19(16)23-17;1-16(26)15-24-11-13-25(14-12-24)20(27)22-9-3-2-6-18-8-7-17-5-4-10-21-19(17)23-18;23-19-13-15(11-12-22(19)14-20(24)25)5-1-3-7-17-10-9-16-6-2-4-8-18(16)21-17;23-19(16-10-12-22(13-11-16)14-20(24)25)7-3-5-17-9-8-15-4-1-2-6-18(15)21-17;23-17(21-10-11-22(13-19(25)26)18(24)12-21)7-3-5-15-9-8-14-4-1-2-6-16(14)20-15;23-18(22-12-10-21(11-13-22)14-19(24)25)7-3-5-16-9-8-15-4-1-2-6-17(15)20-16/h5-6,18-19H,1-4,7-17H2,(H,27,28);12-13H,2-11,14-15H2,1H3,(H,22,28);7-8,18H,2-6,9-15H2,1H3,(H,22,24)(H,23,27);7-8H,2-6,9-14H2,1H3,(H,21,23)(H,22,28);7-8H,2-6,9-15H2,1H3,(H,21,23)(H,22,27);9-10,15H,1-8,11-14H2,(H,24,25);8-9,16H,1-7,10-14H2,(H,24,25);8-9H,1-7,10-13H2,(H,25,26);8-9H,1-7,10-14H2,(H,24,25)
InChIKeyAZTZCWXEFJXDFY-UHFFFAOYSA-N
XLogP18.00
TPSA691.37 Ų
H-Bond Donors12
H-Bond Acceptors38
Rotatable Bonds61
Heavy Atoms239
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003299.32
LogP ≤ 518.00
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid?
The IUPAC name of 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid (CID 157282090) is 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid.
What is the SMILES notation for 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid?
The canonical SMILES for 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid is CC(=O)CN1CCC(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1.CC(=O)CN1CCN(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1.CC(=O)CN1CCN(C(=O)NCCCCc2ccc3c(n2)NCCC3)CC1=O.CC(=O)CN1CCN(C(=O)NCCCCc2cnc3c(c2)CCCC3)CC1=O.O=C(O)CN1CCC(C(=O)CCCc2ccc3c(n2)CCCC3)CC1.O=C(O)CN1CCC(CCCCc2ccc3c(n2)CCCC3)CC1=O.O=C(O)CN1CCC(CN2CCC(Cc3ccc4c(n3)CCCC4)CC2)CC1.O=C(O)CN1CCN(C(=O)CCCc2ccc3c(n2)CCCC3)CC1.O=C(O)CN1CCN(C(=O)CCCc2ccc3c(n2)CCCC3)CC1=O.
What is the InChIKey of 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid?
The InChIKey is AZTZCWXEFJXDFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H35N3O2.C21H30N4O3.C21H32N4O2.C20H29N5O3.C20H31N5O2.2C20H28N2O3.C19H25N3O4.C19H27N3O3/c27-23(28)17-26-13-9-19(10-14-26)16-25-11-7-18(8-12-25)15-21-6-5-20-3-1-2-4-22(20)24-21;1-16(26)14-24-10-11-25(15-20(24)27)21(28)22-9-5-4-6-17-12-18-7-2-3-8-19(18)23-13-17;1-16(26)15-25-13-9-18(10-14-25)21(27)23-11-3-2-6-19-8-7-17-5-4-12-22-20(17)24-19;1-15(26)13-24-11-12-25(14-18(24)27)20(28)22-9-3-2-6-17-8-7-16-5-4-10-21-19(16)23-17;1-16(26)15-24-11-13-25(14-12-24)20(27)22-9-3-2-6-18-8-7-17-5-4-10-21-19(17)23-18;23-19-13-15(11-12-22(19)14-20(24)25)5-1-3-7-17-10-9-16-6-2-4-8-18(16)21-17;23-19(16-10-12-22(13-11-16)14-20(24)25)7-3-5-17-9-8-15-4-1-2-6-18(15)21-17;23-17(21-10-11-22(13-19(25)26)18(24)12-21)7-3-5-15-9-8-14-4-1-2-6-16(14)20-15;23-18(22-12-10-21(11-13-22)14-19(24)25)7-3-5-16-9-8-15-4-1-2-6-17(15)20-16/h5-6,18-19H,1-4,7-17H2,(H,27,28);12-13H,2-11,14-15H2,1H3,(H,22,28);7-8,18H,2-6,9-15H2,1H3,(H,22,24)(H,23,27);7-8H,2-6,9-14H2,1H3,(H,21,23)(H,22,28);7-8H,2-6,9-15H2,1H3,(H,21,23)(H,22,27);9-10,15H,1-8,11-14H2,(H,24,25);8-9,16H,1-7,10-14H2,(H,24,25);8-9H,1-7,10-13H2,(H,25,26);8-9H,1-7,10-14H2,(H,24,25).
What are the key properties of 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid?
3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid has a molecular weight of 3299.32 g/mol, XLogP of 18.00, 61 rotatable bonds, 12 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;3-oxo-4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydroquinolin-3-yl)butyl]piperazine-1-carboxamide;4-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperazine-1-carboxamide;1-(2-oxopropyl)-N-[4-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)butyl]piperidine-4-carboxamide;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[2-oxo-4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butyl]piperidin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperazin-1-yl]acetic acid;2-[4-[4-(5,6,7,8-tetrahydroquinolin-2-yl)butanoyl]piperidin-1-yl]acetic acid;2-[4-[[4-(5,6,7,8-tetrahydroquinolin-2-ylmethyl)piperidin-1-yl]methyl]piperidin-1-yl]acetic acid is sourced from PubChem (CID 157282090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).