N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide

C17H23N3O2 — CID 51085603

IUPACN-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC(=O)N2CCCC2)cc1
InChIInChI=1S/C17H23N3O2/c21-16(18-14-5-1-2-6-14)13-7-9-15(10-8-13)19-17(22)20-11-3-4-12-20/h7-10,14H,1-6,11-12H2,(H,18,21)(H,19,22)
InChIKeyIQBOTICQTBXGPN-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.99
Rot. Bonds3

About N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide

N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide (PubChem CID 51085603) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide
PubChem CID51085603
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC NameN-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide
SMILESO=C(NC1CCCC1)c1ccc(NC(=O)N2CCCC2)cc1
InChIInChI=1S/C17H23N3O2/c21-16(18-14-5-1-2-6-14)13-7-9-15(10-8-13)19-17(22)20-11-3-4-12-20/h7-10,14H,1-6,11-12H2,(H,18,21)(H,19,22)
InChIKeyIQBOTICQTBXGPN-UHFFFAOYSA-N
XLogP2.99
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-[4-(cyclopentylcarbamoyl)phenyl]-3-hydroxypiperidine-1-carboxamide
CID 94153607
3-N-[4-(cyclopropylcarbamoyl)phenyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 55489108
4-acetamido-N-cyclooctylbenzamide
CID 2990044
N-[4-(cyclopentylcarbamoyl)-2-methylphenyl]azepane-1-carboxamide
CID 48645800
4-(pyrrolidine-1-carbonylamino)benzoic acid
CID 39732858
4-benzamido-N-cyclopentylbenzamide
CID 1262350
4-(4-benzamidopiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide
CID 33308938
N-cyclopropyl-4-(pyrrolidine-1-carbonyl)benzamide
CID 109043261
4-[(2-chloroacetyl)amino]-N-cyclopentylbenzamide
CID 16640624
4-N-(4-chlorophenyl)-1-N-cyclopentylbenzene-1,4-dicarboxamide
CID 109044491
N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]pyrrolidine-1-carboxamide
CID 47039794
N-phenyl-4-[[4-(phenylsulfamoyl)benzoyl]amino]piperidine-1-carboxamide
CID 46537325

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide (CID 51085603) is N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide is O=C(NC1CCCC1)c1ccc(NC(=O)N2CCCC2)cc1.
What is the InChIKey of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide?
The InChIKey is IQBOTICQTBXGPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c21-16(18-14-5-1-2-6-14)13-7-9-15(10-8-13)19-17(22)20-11-3-4-12-20/h7-10,14H,1-6,11-12H2,(H,18,21)(H,19,22).
What are the key properties of N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide?
N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 51085603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).