N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide

C18H24N2O2 — CID 53015958

IUPACN-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide
SMILESCc1ccc(C(=O)N2CCCC2C(=O)NC2CCCC2)cc1
InChIInChI=1S/C18H24N2O2/c1-13-8-10-14(11-9-13)18(22)20-12-4-7-16(20)17(21)19-15-5-2-3-6-15/h8-11,15-16H,2-7,12H2,1H3,(H,19,21)
InChIKeyVNVJJPLBAGJPHR-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.66
Rot. Bonds3

About N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide

N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide (PubChem CID 53015958) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide
PubChem CID53015958
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide
SMILESCc1ccc(C(=O)N2CCCC2C(=O)NC2CCCC2)cc1
InChIInChI=1S/C18H24N2O2/c1-13-8-10-14(11-9-13)18(22)20-12-4-7-16(20)17(21)19-15-5-2-3-6-15/h8-11,15-16H,2-7,12H2,1H3,(H,19,21)
InChIKeyVNVJJPLBAGJPHR-UHFFFAOYSA-N
XLogP2.66
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-N-cyclohexyl-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2-carboxamide
CID 110285809
(2R)-N-cyclopropyl-1-(4-ethoxybenzoyl)pyrrolidine-2-carboxamide
CID 94061711
(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide
CID 10315888
(2S)-1-(4-methylbenzoyl)-N-phenylpyrrolidine-2-carboxamide
CID 92668343
N-cyclopropyl-1-[4-[(2,5-dimethylphenyl)sulfonylamino]benzoyl]pyrrolidine-2-carboxamide
CID 50830884
N-cyclopropyl-1-(6-fluoropyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 63979920
1-(4-methylbenzoyl)-N-(3-methylphenyl)pyrrolidine-2-carboxamide
CID 46756185
N-cyclopropyl-1-[4-(trifluoromethoxy)benzoyl]pyrrolidine-2-carboxamide
CID 86924377
1-(2-bromo-5-methylbenzoyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 80973644
(2R)-N-cyclopropyl-1-[4-[(2-methylbenzoyl)amino]benzoyl]pyrrolidine-2-carboxamide
CID 92729944
N-cyclopropyl-1-(2-methylbenzoyl)pyrrolidine-2-carboxamide
CID 47158357
[1-(4-methylbenzoyl)pyrrolidin-2-yl]-phenylmethanone
CID 110357637

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide (CID 53015958) is N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide is Cc1ccc(C(=O)N2CCCC2C(=O)NC2CCCC2)cc1.
What is the InChIKey of N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide?
The InChIKey is VNVJJPLBAGJPHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-13-8-10-14(11-9-13)18(22)20-12-4-7-16(20)17(21)19-15-5-2-3-6-15/h8-11,15-16H,2-7,12H2,1H3,(H,19,21).
What are the key properties of N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide?
N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide has a molecular weight of 300.40 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 53015958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).