(2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide

C15H22N2O2 — CID 92548251

IUPAC(2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide
SMILESO=C(NC1CCCCC1)[C@H]1C=CCN1C(=O)C1CC1
InChIInChI=1S/C15H22N2O2/c18-14(16-12-5-2-1-3-6-12)13-7-4-10-17(13)15(19)11-8-9-11/h4,7,11-13H,1-3,5-6,8-10H2,(H,16,18)/t13-/m1/s1
InChIKeyAPVHXMWDNDLZHX-CYBMUJFWSA-N
MW262.35 g/mol
LogP1.61
Rot. Bonds3

About (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide

(2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide (PubChem CID 92548251) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide
PubChem CID92548251
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide
SMILESO=C(NC1CCCCC1)[C@H]1C=CCN1C(=O)C1CC1
InChIInChI=1S/C15H22N2O2/c18-14(16-12-5-2-1-3-6-12)13-7-4-10-17(13)15(19)11-8-9-11/h4,7,11-13H,1-3,5-6,8-10H2,(H,16,18)/t13-/m1/s1
InChIKeyAPVHXMWDNDLZHX-CYBMUJFWSA-N
XLogP1.61
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

1-acetyl-N-(cyclopropylmethyl)-5-methyl-2H-pyrrole-5-carboxamide
CID 5459671
1-acetyl-N-(cyclopropylmethyl)-5-(2-methylpropyl)-2H-pyrrole-5-carboxamide
CID 5459652
(2S)-N-cyclohexyl-N-(cyclopropylmethyl)-2,5-dihydro-1H-pyrrole-2-carboxamide
CID 164642181
(E)-N-cyclohexyl-3-methyl-2-(2-oxopyrrolidin-1-yl)pent-3-enamide
CID 134847370
(2R)-1-(cyclohexanecarbonyl)-N-prop-2-enyl-2,5-dihydropyrrole-2-carboxamide
CID 51583259
(2S)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide
CID 92548250
(2R)-1-(cyclopropanecarbonyl)-N-prop-2-enyl-2,5-dihydropyrrole-2-carboxamide
CID 110244525
1-cyclohexyl-6-(propan-2-ylamino)-5,6-dihydro-2H-azepin-7-one
CID 20589776
(E)-N,5-dimethyl-2-[(2R)-2-methylpiperidin-1-yl]hex-3-enamide
CID 59075638
(2S)-1-butanoyl-N-[(1R,2S)-2-[(Z)-pent-1-enyl]cyclopropyl]pyrrolidine-2-carboxamide
CID 70296506
(6S)-1-cyclohexyl-6-(propan-2-ylamino)-5,6-dihydro-2H-azepin-7-one
CID 71093831
(6S)-1-cyclohexyl-6-(methylamino)-5,6-dihydro-2H-azepin-7-one
CID 71094755

Frequently Asked Questions

What is the IUPAC name of (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide?
The IUPAC name of (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide (CID 92548251) is (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide.
What is the SMILES notation for (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide?
The canonical SMILES for (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide is O=C(NC1CCCCC1)[C@H]1C=CCN1C(=O)C1CC1.
What is the InChIKey of (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide?
The InChIKey is APVHXMWDNDLZHX-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H22N2O2/c18-14(16-12-5-2-1-3-6-12)13-7-4-10-17(13)15(19)11-8-9-11/h4,7,11-13H,1-3,5-6,8-10H2,(H,16,18)/t13-/m1/s1.
What are the key properties of (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide?
(2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-cyclohexyl-1-(cyclopropanecarbonyl)-2,5-dihydropyrrole-2-carboxamide is sourced from PubChem (CID 92548251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).