N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide

C19H27N3O2 — CID 119303603

IUPACN-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)C1CCCCN1
InChIInChI=1S/C19H27N3O2/c23-18(22-13-3-4-14-22)11-8-15-6-9-16(10-7-15)21-19(24)17-5-1-2-12-20-17/h6-7,9-10,17,20H,1-5,8,11-14H2,(H,21,24)
InChIKeyREYQBQBPWFKWQI-UHFFFAOYSA-N
MW329.44 g/mol
LogP2.32
Rot. Bonds5

About N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide

N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide (PubChem CID 119303603) has the molecular formula C19H27N3O2 and a molecular weight of 329.44 g/mol. Its IUPAC name is N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide
PubChem CID119303603
Molecular FormulaC19H27N3O2
Molecular Weight329.44 g/mol
Exact Mass329.21
IUPAC NameN-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide
SMILESO=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)C1CCCCN1
InChIInChI=1S/C19H27N3O2/c23-18(22-13-3-4-14-22)11-8-15-6-9-16(10-7-15)21-19(24)17-5-1-2-12-20-17/h6-7,9-10,17,20H,1-5,8,11-14H2,(H,21,24)
InChIKeyREYQBQBPWFKWQI-UHFFFAOYSA-N
XLogP2.32
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.44
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-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

3-[4-(pyrrolidine-2-carbonylamino)phenyl]propanoic acid
CID 115339993
(2R)-N-[4-(2-morpholin-4-ylethyl)phenyl]piperidine-2-carboxamide
CID 119860916
3-(4-piperidin-2-ylphenyl)-1-pyrrolidin-1-ylpropan-1-one
CID 69037109
N-(4-pyrrolidin-1-ylphenyl)azepane-2-carboxamide
CID 64562834
(2S)-N-(4-butylphenyl)pyrrolidine-2-carboxamide
CID 61156078
3-phenyl-1-[4-(pyrrolidine-2-carbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 119306810
(2R)-N-[4-(aminomethyl)phenyl]pyrrolidine-2-carboxamide
CID 143190903
N-(3-oxo-3-pyrrolidin-1-ylpropyl)piperidine-2-carboxamide
CID 61249088
N-[4-(2-methylsulfanylethyl)phenyl]pyrrolidine-2-carboxamide
CID 119315477
3-(4-fluorophenyl)-N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]propanamide
CID 110633755
N-[4-[(carbamoylamino)methyl]phenyl]piperidine-2-carboxamide;hydrochloride
CID 119308499
(2R)-N-(4-pyrrolidin-1-ylphenyl)pyrrolidine-2-carboxamide
CID 93029701

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide?
The IUPAC name of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide (CID 119303603) is N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide?
The canonical SMILES for N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide is O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)C1CCCCN1.
What is the InChIKey of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide?
The InChIKey is REYQBQBPWFKWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O2/c23-18(22-13-3-4-14-22)11-8-15-6-9-16(10-7-15)21-19(24)17-5-1-2-12-20-17/h6-7,9-10,17,20H,1-5,8,11-14H2,(H,21,24).
What are the key properties of N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide?
N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide has a molecular weight of 329.44 g/mol, XLogP of 2.32, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-oxo-3-pyrrolidin-1-ylpropyl)phenyl]piperidine-2-carboxamide is sourced from PubChem (CID 119303603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).