2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide

C20H23NO — CID 4072324

IUPAC2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)C1CC1c1ccccc1
InChIInChI=1S/C20H23NO/c1-15(12-13-16-8-4-2-5-9-16)21-20(22)19-14-18(19)17-10-6-3-7-11-17/h2-11,15,18-19H,12-14H2,1H3,(H,21,22)
InChIKeyKQIKUEMEPOYEBC-UHFFFAOYSA-N
MW293.41 g/mol
LogP3.93
Rot. Bonds6

About 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide

2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide (PubChem CID 4072324) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide
PubChem CID4072324
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Name2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)C1CC1c1ccccc1
InChIInChI=1S/C20H23NO/c1-15(12-13-16-8-4-2-5-9-16)21-20(22)19-14-18(19)17-10-6-3-7-11-17/h2-11,15,18-19H,12-14H2,1H3,(H,21,22)
InChIKeyKQIKUEMEPOYEBC-UHFFFAOYSA-N
XLogP3.93
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-bromobutan-2-yl)-2-phenylcyclopropane-1-carboxamide
CID 83180682
(1S,6R)-3,4-dimethyl-6-[[(2S)-4-phenylbutan-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 7409293
N-[(2S)-4-phenylbutan-2-yl]cyclopropanecarboxamide
CID 844321
4-(methylamino)-N-(4-phenylbutan-2-yl)oxolane-3-carboxamide
CID 66265448
(2R)-4-hydroxy-2-[(2-phenylcyclopropanecarbonyl)amino]butanoic acid
CID 107823606
1-acetyl-N-(4-phenylbutan-2-yl)azetidine-3-carboxamide
CID 71785218
cis-(1S,2R)-2-phenyl-N'-(3-phenylpropanoyl)cyclopropane-1-carbohydrazide
CID 787540
(2S)-2-[(2-phenylcyclopropanecarbonyl)amino]hexanoic acid
CID 107144642
N-(1,3-diphenylpropyl)-2-methylcyclopropane-1-carboxamide
CID 56796182
(1R)-N-[(2S)-1-amino-1-oxobutan-2-yl]-2-phenylcyclopropane-1-carboxamide
CID 58155377
(2R,3R)-3-[[(2R)-4-phenylbutan-2-yl]carbamoyl]bicyclo[2.2.2]octane-2-carboxylic acid
CID 124771454
N-(1-chloro-4,4-dimethylpentan-3-yl)-2-phenylcyclopropane-1-carboxamide
CID 106355534

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide (CID 4072324) is 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide is CC(CCc1ccccc1)NC(=O)C1CC1c1ccccc1.
What is the InChIKey of 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide?
The InChIKey is KQIKUEMEPOYEBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-15(12-13-16-8-4-2-5-9-16)21-20(22)19-14-18(19)17-10-6-3-7-11-17/h2-11,15,18-19H,12-14H2,1H3,(H,21,22).
What are the key properties of 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide?
2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 293.41 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(4-phenylbutan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 4072324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).