(4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide

C19H26N4O2 — CID 95149170

IUPAC(4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESNC(=O)c1cc2c(cc1N1CCCC1)NC(=O)C[C@@H]2C1CCNCC1
InChIInChI=1S/C19H26N4O2/c20-19(25)15-9-14-13(12-3-5-21-6-4-12)10-18(24)22-16(14)11-17(15)23-7-1-2-8-23/h9,11-13,21H,1-8,10H2,(H2,20,25)(H,22,24)/t13-/m1/s1
InChIKeyLBCHMGHZXXTCBB-CYBMUJFWSA-N
MW342.44 g/mol
LogP1.81
Rot. Bonds3

About (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide

(4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide (PubChem CID 95149170) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide.

Molecular Properties

Compound Name(4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
PubChem CID95149170
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name(4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
SMILESNC(=O)c1cc2c(cc1N1CCCC1)NC(=O)C[C@@H]2C1CCNCC1
InChIInChI=1S/C19H26N4O2/c20-19(25)15-9-14-13(12-3-5-21-6-4-12)10-18(24)22-16(14)11-17(15)23-7-1-2-8-23/h9,11-13,21H,1-8,10H2,(H2,20,25)(H,22,24)/t13-/m1/s1
InChIKeyLBCHMGHZXXTCBB-CYBMUJFWSA-N
XLogP1.81
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide with MolForge

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Related Compounds

(4R)-4-(2-methylsulfanylethyl)-2-oxo-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
CID 95132095
(4S)-2-oxo-4-pyridin-2-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
CID 95140597
(4R)-2-oxo-4-[(E)-2-phenylethenyl]-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
CID 95119603
4-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-oxo-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
CID 169416286
(4S)-4-[(E)-1-(furan-2-yl)prop-1-en-2-yl]-2-oxo-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide
CID 95144233
4-(2,6-dioxopiperidin-4-yl)-2-piperidin-1-ylbenzamide
CID 69277245
4-chloro-2-(1,4-diazepan-1-yl)benzamide
CID 63082408
1-(7-amino-3-oxo-4H-1,4-benzoxazin-6-yl)piperidine-3-carboxamide
CID 43479138
4-chloro-2-pyrrolidin-1-ylbenzamide
CID 175755085
5-chloro-2-piperazin-1-ylbenzamide
CID 62494814
ethyl N-[(4R)-4-cyclopentyl-2-oxo-3,4-dihydro-1H-quinolin-7-yl]carbamate
CID 95128759
2,6-dimethyl-4-piperazin-1-ylpyridine-3-carboxamide
CID 81050845

Frequently Asked Questions

What is the IUPAC name of (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide?
The IUPAC name of (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide (CID 95149170) is (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide.
What is the SMILES notation for (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide?
The canonical SMILES for (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide is NC(=O)c1cc2c(cc1N1CCCC1)NC(=O)C[C@@H]2C1CCNCC1.
What is the InChIKey of (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide?
The InChIKey is LBCHMGHZXXTCBB-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H26N4O2/c20-19(25)15-9-14-13(12-3-5-21-6-4-12)10-18(24)22-16(14)11-17(15)23-7-1-2-8-23/h9,11-13,21H,1-8,10H2,(H2,20,25)(H,22,24)/t13-/m1/s1.
What are the key properties of (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide?
(4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide has a molecular weight of 342.44 g/mol, XLogP of 1.81, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2-oxo-4-piperidin-4-yl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinoline-6-carboxamide is sourced from PubChem (CID 95149170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).