(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide

C22H26N2O2 — CID 10315888

IUPAC(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CCCCC1)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C22H26N2O2/c25-21(23-19-9-2-1-3-10-19)20-11-6-14-24(20)22(26)18-13-12-16-7-4-5-8-17(16)15-18/h4-5,7-8,12-13,15,19-20H,1-3,6,9-11,14H2,(H,23,25)/t20-/m0/s1
InChIKeyWCYLEXLBXABSMO-FQEVSTJZSA-N
MW350.46 g/mol
LogP3.89
Rot. Bonds3

About (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide

(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 10315888) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide
PubChem CID10315888
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC Name(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide
SMILESO=C(NC1CCCCC1)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1
InChIInChI=1S/C22H26N2O2/c25-21(23-19-9-2-1-3-10-19)20-11-6-14-24(20)22(26)18-13-12-16-7-4-5-8-17(16)15-18/h4-5,7-8,12-13,15,19-20H,1-3,6,9-11,14H2,(H,23,25)/t20-/m0/s1
InChIKeyWCYLEXLBXABSMO-FQEVSTJZSA-N
XLogP3.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.46
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 10508341
N-cyclopentyl-1-(4-methylbenzoyl)pyrrolidine-2-carboxamide
CID 53015958
(2S)-N-cyclohexyl-1-(3-pyrrol-1-ylbenzoyl)pyrrolidine-2-carboxamide
CID 110305765
N-cyclopentyl-1-(3-pyridin-2-ylbenzoyl)pyrrolidine-2-carboxamide
CID 134799641
(2S)-N-cyclohexyl-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2-carboxamide
CID 110285809
N-cyclopropyl-1-(3-iodobenzoyl)pyrrolidine-2-carboxamide
CID 47158356
1-(4-amino-3-hydroxybenzoyl)-N-cyclopropylpyrrolidine-2-carboxamide
CID 107074446
phenyl 2-(cyclohexylcarbamoyl)pyrrolidine-1-carboxylate
CID 3112487
(2R)-N-cyclohexyl-1-[3-[(2-methylbenzoyl)amino]benzoyl]pyrrolidine-2-carboxamide
CID 92728157
N-cyclopropyl-1-(2-fluoropyridine-4-carbonyl)pyrrolidine-2-carboxamide
CID 61293291
(2R)-N-cyclopropyl-1-(4-ethoxybenzoyl)pyrrolidine-2-carboxamide
CID 94061711
2-(1-benzoylpyrrolidin-2-yl)-N-cyclohexyl-2-oxoacetamide
CID 67878467

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide (CID 10315888) is (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide is O=C(NC1CCCCC1)[C@@H]1CCCN1C(=O)c1ccc2ccccc2c1.
What is the InChIKey of (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is WCYLEXLBXABSMO-FQEVSTJZSA-N. The full InChI is InChI=1S/C22H26N2O2/c25-21(23-19-9-2-1-3-10-19)20-11-6-14-24(20)22(26)18-13-12-16-7-4-5-8-17(16)15-18/h4-5,7-8,12-13,15,19-20H,1-3,6,9-11,14H2,(H,23,25)/t20-/m0/s1.
What are the key properties of (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide?
(2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 350.46 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclohexyl-1-(naphthalene-2-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 10315888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).