4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide

C22H27N3O2 — CID 5307409

IUPAC4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide
SMILESCc1nc2ccccc2c2oc(C(=O)NCCCN3CCC(C)CC3)cc12
InChIInChI=1S/C22H27N3O2/c1-15-8-12-25(13-9-15)11-5-10-23-22(26)20-14-18-16(2)24-19-7-4-3-6-17(19)21(18)27-20/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,23,26)
InChIKeyUKTGTHRVLPFQQU-UHFFFAOYSA-N
MW365.48 g/mol
LogP4.14
Rot. Bonds5

About 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide

4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide (PubChem CID 5307409) has the molecular formula C22H27N3O2 and a molecular weight of 365.48 g/mol. Its IUPAC name is 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound Name4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide
PubChem CID5307409
Molecular FormulaC22H27N3O2
Molecular Weight365.48 g/mol
Exact Mass365.21
IUPAC Name4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide
SMILESCc1nc2ccccc2c2oc(C(=O)NCCCN3CCC(C)CC3)cc12
InChIInChI=1S/C22H27N3O2/c1-15-8-12-25(13-9-15)11-5-10-23-22(26)20-14-18-16(2)24-19-7-4-3-6-17(19)21(18)27-20/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,23,26)
InChIKeyUKTGTHRVLPFQQU-UHFFFAOYSA-N
XLogP4.14
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide?
The IUPAC name of 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide (CID 5307409) is 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide is Cc1nc2ccccc2c2oc(C(=O)NCCCN3CCC(C)CC3)cc12.
What is the InChIKey of 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide?
The InChIKey is UKTGTHRVLPFQQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O2/c1-15-8-12-25(13-9-15)11-5-10-23-22(26)20-14-18-16(2)24-19-7-4-3-6-17(19)21(18)27-20/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,23,26).
What are the key properties of 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide?
4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-[3-(4-methylpiperidin-1-yl)propyl]furo[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 5307409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).