N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

C17H23N3O2 — CID 119713611

IUPACN-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC(=O)C2CCNC2)cc1
InChIInChI=1S/C17H23N3O2/c21-16(19-14-3-1-2-4-14)12-5-7-15(8-6-12)20-17(22)13-9-10-18-11-13/h5-8,13-14,18H,1-4,9-11H2,(H,19,21)(H,20,22)
InChIKeyFRGFSNRBAVYOFJ-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.91
Rot. Bonds4

About N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide (PubChem CID 119713611) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
PubChem CID119713611
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC(=O)C2CCNC2)cc1
InChIInChI=1S/C17H23N3O2/c21-16(19-14-3-1-2-4-14)12-5-7-15(8-6-12)20-17(22)13-9-10-18-11-13/h5-8,13-14,18H,1-4,9-11H2,(H,19,21)(H,20,22)
InChIKeyFRGFSNRBAVYOFJ-UHFFFAOYSA-N
XLogP1.91
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyclopropanecarbonylamino)-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119453816
N-[4-(ethylcarbamoyl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119714145
N-[4-chloro-3-(cyclohexylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 119300196
N-(4-chlorophenyl)pyrrolidine-3-carboxamide
CID 63006642
N-[4-(propan-2-ylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 60927369
N-[4-(phenylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119307803
(2S,4S)-N-[4-(cyclopropylcarbamoyl)phenyl]-2-methylpiperidine-4-carboxamide
CID 120619355
N-[4-(cyclopropylcarbamoyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 78982521
(2S)-N-[4-(cyclopropylcarbamoyl)phenyl]piperidine-2-carboxamide
CID 103808292
N-[4-(propylcarbamoyl)phenyl]piperidine-3-carboxamide;hydrochloride
CID 119297921
4-acetamido-N-cyclooctylbenzamide
CID 2990044
N-cyclopropyl-4-(pyrrolidin-3-ylamino)benzamide
CID 79724165

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
The IUPAC name of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide (CID 119713611) is N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide is O=C(NC1CCCC1)c1ccc(NC(=O)C2CCNC2)cc1.
What is the InChIKey of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
The InChIKey is FRGFSNRBAVYOFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c21-16(19-14-3-1-2-4-14)12-5-7-15(8-6-12)20-17(22)13-9-10-18-11-13/h5-8,13-14,18H,1-4,9-11H2,(H,19,21)(H,20,22).
What are the key properties of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 1.91, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 119713611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).