N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide

C17H23N3O2 — CID 119740159

IUPACN-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCCCC2)c1)C1CCNC1
InChIInChI=1S/C17H23N3O2/c21-16(14-7-8-18-12-14)19-15-6-4-5-13(11-15)17(22)20-9-2-1-3-10-20/h4-6,11,14,18H,1-3,7-10,12H2,(H,19,21)
InChIKeyVGHXMCFRDKRELL-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.86
Rot. Bonds3

About N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide

N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide (PubChem CID 119740159) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide
PubChem CID119740159
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide
SMILESO=C(Nc1cccc(C(=O)N2CCCCC2)c1)C1CCNC1
InChIInChI=1S/C17H23N3O2/c21-16(14-7-8-18-12-14)19-15-6-4-5-13(11-15)17(22)20-9-2-1-3-10-20/h4-6,11,14,18H,1-3,7-10,12H2,(H,19,21)
InChIKeyVGHXMCFRDKRELL-UHFFFAOYSA-N
XLogP1.86
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[3-(piperidine-1-carbonyl)phenyl]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

(2S,4S)-2-methyl-N-[3-(piperidine-1-carbonyl)phenyl]piperidine-4-carboxamide
CID 120624438
(2S,4S)-2-methyl-N-[3-(piperidine-1-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 120624437
N-[3-(morpholine-4-carbonyl)phenyl]piperidine-4-carboxamide;hydrochloride
CID 119283240
N-[3-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]phenyl]cyclopropanecarboxamide
CID 31611202
N-[3-(pyrrolidine-1-carbonyl)phenyl]-1-(2,2,2-trifluoroacetyl)piperidine-4-carboxamide
CID 112506999
trans-(1S,2S)-2-[[3-(piperidine-1-carbonyl)phenyl]carbamoyl]cyclohexane-1-carboxylate
CID 6964103
N-[3-(dimethylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 55148926
N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide
CID 119759921
N-(3-benzoylphenyl)piperidine-3-carboxamide
CID 119279700
N-[2-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide
CID 119685018
N-(3-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 63006855
(3R)-N-(3-hydroxyphenyl)pyrrolidine-3-carboxamide
CID 94916708

Frequently Asked Questions

What is the IUPAC name of N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide?
The IUPAC name of N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide (CID 119740159) is N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide is O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C1CCNC1.
What is the InChIKey of N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide?
The InChIKey is VGHXMCFRDKRELL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c21-16(14-7-8-18-12-14)19-15-6-4-5-13(11-15)17(22)20-9-2-1-3-10-20/h4-6,11,14,18H,1-3,7-10,12H2,(H,19,21).
What are the key properties of N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide?
N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 1.86, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 119740159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).