N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide

C28H34N4O4 — CID 118756720

IUPACN-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide
SMILESCc1ccc2cc(CN(CCCN3CCCC3=O)C(=O)c3ccco3)c(N3CCCC(O)C3)nc2c1
InChIInChI=1S/C28H34N4O4/c1-20-9-10-21-17-22(27(29-24(21)16-20)31-12-2-6-23(33)19-31)18-32(28(35)25-7-4-15-36-25)14-5-13-30-11-3-8-26(30)34/h4,7,9-10,15-17,23,33H,2-3,5-6,8,11-14,18-19H2,1H3
InChIKeyRAZIFLVJYCMNOB-UHFFFAOYSA-N
MW490.60 g/mol
LogP3.75
Rot. Bonds8

About N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide

N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide (PubChem CID 118756720) has the molecular formula C28H34N4O4 and a molecular weight of 490.60 g/mol. Its IUPAC name is N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide
PubChem CID118756720
Molecular FormulaC28H34N4O4
Molecular Weight490.60 g/mol
Exact Mass490.26
IUPAC NameN-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide
SMILESCc1ccc2cc(CN(CCCN3CCCC3=O)C(=O)c3ccco3)c(N3CCCC(O)C3)nc2c1
InChIInChI=1S/C28H34N4O4/c1-20-9-10-21-17-22(27(29-24(21)16-20)31-12-2-6-23(33)19-31)18-32(28(35)25-7-4-15-36-25)14-5-13-30-11-3-8-26(30)34/h4,7,9-10,15-17,23,33H,2-3,5-6,8,11-14,18-19H2,1H3
InChIKeyRAZIFLVJYCMNOB-UHFFFAOYSA-N
XLogP3.75
TPSA90.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500490.60
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide 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

N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-4-methyl-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CID 45240414
N-[[2-(azepan-1-yl)-7-chloroquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide
CID 26282437
3-methoxy-N-[(7-methoxy-2-morpholin-4-ylquinolin-3-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CID 42406671
(3R)-1-[6-methyl-3-[[methyl-[2-(1H-pyrazol-4-yl)ethyl]amino]methyl]quinolin-2-yl]piperidin-3-ol
CID 95874018
N-(1,3-benzodioxol-5-ylmethyl)-N-[(7-methylsulfanyl-2-pyrrolidin-1-ylquinolin-3-yl)methyl]furan-2-carboxamide
CID 28953692
N-[[7-chloro-2-(3-methylphenyl)quinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1,3-thiazole-5-carboxamide
CID 42162632
(3R)-1-[3-[(4-ethyl-1,4-diazepan-1-yl)methyl]-6-methylquinolin-2-yl]piperidin-3-ol
CID 99962325
1-[6-methyl-3-[[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]methyl]quinolin-2-yl]piperidin-3-ol
CID 70718622
(3S)-1-[6-methyl-3-[[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]methyl]quinolin-2-yl]piperidin-3-ol
CID 95861413
(3R)-1-[6-methyl-3-[[methyl-[(5-methyl-1H-imidazol-2-yl)methyl]amino]methyl]quinolin-2-yl]piperidin-3-ol
CID 95861414
N-[[7-chloro-2-(3-methylphenyl)quinolin-3-yl]methyl]-2-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 45181635
3-methoxy-N-[(6-methyl-2-thiophen-2-ylquinolin-3-yl)methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]benzamide
CID 42485035

Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide?
The IUPAC name of N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide (CID 118756720) is N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide.
What is the SMILES notation for N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide?
The canonical SMILES for N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide is Cc1ccc2cc(CN(CCCN3CCCC3=O)C(=O)c3ccco3)c(N3CCCC(O)C3)nc2c1.
What is the InChIKey of N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide?
The InChIKey is RAZIFLVJYCMNOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H34N4O4/c1-20-9-10-21-17-22(27(29-24(21)16-20)31-12-2-6-23(33)19-31)18-32(28(35)25-7-4-15-36-25)14-5-13-30-11-3-8-26(30)34/h4,7,9-10,15-17,23,33H,2-3,5-6,8,11-14,18-19H2,1H3.
What are the key properties of N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide?
N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide has a molecular weight of 490.60 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-hydroxypiperidin-1-yl)-7-methylquinolin-3-yl]methyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]furan-2-carboxamide is sourced from PubChem (CID 118756720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).