1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one

C100H128N20O8 — CID 157343131

IUPAC1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one
SMILESCCN(CC)CCOc1ccc(Nc2cc3[nH]c(=O)c(C(C)C)cc3cn2)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(C(C)C)c(=O)n3C2CCC2)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(C(C)C)c(=O)n3C2CCCC2)nc1.CCn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccc(OCCN(C)C)cn3)cc21
InChIInChI=1S/C27H37N5O2.C26H35N5O2.C25H27N5O2.C22H29N5O2/c1-5-31(6-2)13-14-34-22-11-12-25(29-18-22)30-26-16-24-20(17-28-26)15-23(19(3)4)27(33)32(24)21-9-7-8-10-21;1-5-30(6-2)12-13-33-21-10-11-24(28-17-21)29-25-15-23-19(16-27-25)14-22(18(3)4)26(32)31(23)20-8-7-9-20;1-4-30-22-15-24(28-23-11-10-20(17-27-23)32-13-12-29(2)3)26-16-19(22)14-21(25(30)31)18-8-6-5-7-9-18;1-5-27(6-2)9-10-29-17-7-8-20(24-14-17)26-21-12-19-16(13-23-21)11-18(15(3)4)22(28)25-19/h11-12,15-19,21H,5-10,13-14H2,1-4H3,(H,28,29,30);10-11,14-18,20H,5-9,12-13H2,1-4H3,(H,27,28,29);5-11,14-17H,4,12-13H2,1-3H3,(H,26,27,28);7-8,11-15H,5-6,9-10H2,1-4H3,(H,25,28)(H,23,24,26)
InChIKeyBGQFQISEADRYHZ-UHFFFAOYSA-N
MW1738.26 g/mol
LogP18.67
Rot. Bonds37

About 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one

1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one (PubChem CID 157343131) has the molecular formula C100H128N20O8 and a molecular weight of 1738.26 g/mol. Its IUPAC name is 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one.

Molecular Properties

Compound Name1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one
PubChem CID157343131
Molecular FormulaC100H128N20O8
Molecular Weight1738.26 g/mol
Exact Mass1737.02
IUPAC Name1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one
SMILESCCN(CC)CCOc1ccc(Nc2cc3[nH]c(=O)c(C(C)C)cc3cn2)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(C(C)C)c(=O)n3C2CCC2)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(C(C)C)c(=O)n3C2CCCC2)nc1.CCn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccc(OCCN(C)C)cn3)cc21
InChIInChI=1S/C27H37N5O2.C26H35N5O2.C25H27N5O2.C22H29N5O2/c1-5-31(6-2)13-14-34-22-11-12-25(29-18-22)30-26-16-24-20(17-28-26)15-23(19(3)4)27(33)32(24)21-9-7-8-10-21;1-5-30(6-2)12-13-33-21-10-11-24(28-17-21)29-25-15-23-19(16-27-25)14-22(18(3)4)26(32)31(23)20-8-7-9-20;1-4-30-22-15-24(28-23-11-10-20(17-27-23)32-13-12-29(2)3)26-16-19(22)14-21(25(30)31)18-8-6-5-7-9-18;1-5-27(6-2)9-10-29-17-7-8-20(24-14-17)26-21-12-19-16(13-23-21)11-18(15(3)4)22(28)25-19/h11-12,15-19,21H,5-10,13-14H2,1-4H3,(H,28,29,30);10-11,14-18,20H,5-9,12-13H2,1-4H3,(H,27,28,29);5-11,14-17H,4,12-13H2,1-3H3,(H,26,27,28);7-8,11-15H,5-6,9-10H2,1-4H3,(H,25,28)(H,23,24,26)
InChIKeyBGQFQISEADRYHZ-UHFFFAOYSA-N
XLogP18.67
TPSA299.98 Ų
H-Bond Donors5
H-Bond Acceptors27
Rotatable Bonds37
Heavy Atoms128
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001738.26
LogP ≤ 518.67
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1027

Analyze 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one?
The IUPAC name of 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one (CID 157343131) is 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one.
What is the SMILES notation for 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one?
The canonical SMILES for 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one is CCN(CC)CCOc1ccc(Nc2cc3[nH]c(=O)c(C(C)C)cc3cn2)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(C(C)C)c(=O)n3C2CCC2)nc1.CCN(CC)CCOc1ccc(Nc2cc3c(cn2)cc(C(C)C)c(=O)n3C2CCCC2)nc1.CCn1c(=O)c(-c2ccccc2)cc2cnc(Nc3ccc(OCCN(C)C)cn3)cc21.
What is the InChIKey of 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one?
The InChIKey is BGQFQISEADRYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H37N5O2.C26H35N5O2.C25H27N5O2.C22H29N5O2/c1-5-31(6-2)13-14-34-22-11-12-25(29-18-22)30-26-16-24-20(17-28-26)15-23(19(3)4)27(33)32(24)21-9-7-8-10-21;1-5-30(6-2)12-13-33-21-10-11-24(28-17-21)29-25-15-23-19(16-27-25)14-22(18(3)4)26(32)31(23)20-8-7-9-20;1-4-30-22-15-24(28-23-11-10-20(17-27-23)32-13-12-29(2)3)26-16-19(22)14-21(25(30)31)18-8-6-5-7-9-18;1-5-27(6-2)9-10-29-17-7-8-20(24-14-17)26-21-12-19-16(13-23-21)11-18(15(3)4)22(28)25-19/h11-12,15-19,21H,5-10,13-14H2,1-4H3,(H,28,29,30);10-11,14-18,20H,5-9,12-13H2,1-4H3,(H,27,28,29);5-11,14-17H,4,12-13H2,1-3H3,(H,26,27,28);7-8,11-15H,5-6,9-10H2,1-4H3,(H,25,28)(H,23,24,26).
What are the key properties of 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one?
1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one has a molecular weight of 1738.26 g/mol, XLogP of 18.67, 37 rotatable bonds, 5 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;1-cyclopentyl-7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1,6-naphthyridin-2-one;7-[[5-[2-(diethylamino)ethoxy]-2-pyridinyl]amino]-3-propan-2-yl-1H-1,6-naphthyridin-2-one;7-[[5-[2-(dimethylamino)ethoxy]-2-pyridinyl]amino]-1-ethyl-3-phenyl-1,6-naphthyridin-2-one is sourced from PubChem (CID 157343131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).