N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

C15H21N3O2 — CID 63006645

IUPACN-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
SMILESCCCNC(=O)c1ccccc1NC(=O)C1CCNC1
InChIInChI=1S/C15H21N3O2/c1-2-8-17-15(20)12-5-3-4-6-13(12)18-14(19)11-7-9-16-10-11/h3-6,11,16H,2,7-10H2,1H3,(H,17,20)(H,18,19)
InChIKeyVKWKGFOKEAXRLZ-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.37
Rot. Bonds5

About N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide

N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide (PubChem CID 63006645) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
PubChem CID63006645
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC NameN-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
SMILESCCCNC(=O)c1ccccc1NC(=O)C1CCNC1
InChIInChI=1S/C15H21N3O2/c1-2-8-17-15(20)12-5-3-4-6-13(12)18-14(19)11-7-9-16-10-11/h3-6,11,16H,2,7-10H2,1H3,(H,17,20)(H,18,19)
InChIKeyVKWKGFOKEAXRLZ-UHFFFAOYSA-N
XLogP1.37
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(ethylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 119284316
N-[2-[(4-methylphenyl)methylcarbamoyl]phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119679402
N-[2-(2-morpholin-4-ylethylcarbamoyl)phenyl]pyrrolidine-3-carboxamide
CID 50950015
(3R)-N-[2-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrrolidine-3-carboxamide
CID 95119935
N-[2-[(3-methylphenyl)methylcarbamoyl]phenyl]pyrrolidine-3-carboxamide
CID 50949083
2-[(2-methylcyclopropanecarbonyl)amino]-N-propylbenzamide
CID 47097713
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623
(3R)-N-(2-fluorophenyl)pyrrolidine-3-carboxamide
CID 94915553
N-[2-(methylcarbamoyl)phenyl]piperidine-3-carboxamide
CID 18071955
N-[2-(methoxymethyl)phenyl]pyrrolidine-3-carboxamide
CID 63007076
1-(benzenesulfonyl)-N-[2-(propylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 31288840
N-[2-(piperidine-1-carbonyl)phenyl]pyrrolidine-3-carboxamide
CID 119685018

Frequently Asked Questions

What is the IUPAC name of N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
The IUPAC name of N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide (CID 63006645) is N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide is CCCNC(=O)c1ccccc1NC(=O)C1CCNC1.
What is the InChIKey of N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
The InChIKey is VKWKGFOKEAXRLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-2-8-17-15(20)12-5-3-4-6-13(12)18-14(19)11-7-9-16-10-11/h3-6,11,16H,2,7-10H2,1H3,(H,17,20)(H,18,19).
What are the key properties of N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide?
N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide has a molecular weight of 275.35 g/mol, XLogP of 1.37, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(propylcarbamoyl)phenyl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 63006645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).