N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide

C16H17N3O — CID 156839204

IUPACN-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1cccc(-c2cccnc2)c1)C1CCNC1
InChIInChI=1S/C16H17N3O/c20-16(14-6-8-18-11-14)19-15-5-1-3-12(9-15)13-4-2-7-17-10-13/h1-5,7,9-10,14,18H,6,8,11H2,(H,19,20)
InChIKeyUECBDTQZUYPTCZ-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.30
Rot. Bonds3

About N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide

N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide (PubChem CID 156839204) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide
PubChem CID156839204
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide
SMILESO=C(Nc1cccc(-c2cccnc2)c1)C1CCNC1
InChIInChI=1S/C16H17N3O/c20-16(14-6-8-18-11-14)19-15-5-1-3-12(9-15)13-4-2-7-17-10-13/h1-5,7,9-10,14,18H,6,8,11H2,(H,19,20)
InChIKeyUECBDTQZUYPTCZ-UHFFFAOYSA-N
XLogP2.30
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-pyridin-3-ylphenyl)pyrrolidine-3-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-[3-(1H-pyrazol-5-yl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119707800
N-pyridin-4-ylpyrrolidine-3-carboxamide
CID 63005932
(3R,4R)-4-methyl-N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide
CID 166803782
N-(3-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 63006855
(3R)-N-(3-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 94916708
N-(3-chlorophenyl)pyrrolidine-3-carboxamide
CID 63006640
methane;4-(oxan-4-yl)-N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide
CID 158312980
N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119699668
N-[3-(2-methoxyphenyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119708664
N-(3-pyridin-3-ylphenyl)pyridine-3-carboxamide
CID 110461666
N-[3-(1,3-dioxolan-2-yl)phenyl]pyrrolidine-3-carboxamide
CID 106911880
N-[3-(dimethylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 55148926

Frequently Asked Questions

What is the IUPAC name of N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide (CID 156839204) is N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide is O=C(Nc1cccc(-c2cccnc2)c1)C1CCNC1.
What is the InChIKey of N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide?
The InChIKey is UECBDTQZUYPTCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c20-16(14-6-8-18-11-14)19-15-5-1-3-12(9-15)13-4-2-7-17-10-13/h1-5,7,9-10,14,18H,6,8,11H2,(H,19,20).
What are the key properties of N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide?
N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide has a molecular weight of 267.33 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyridin-3-ylphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 156839204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).