1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide

C19H20FNO — CID 139815337

IUPAC1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide
SMILESCC(C)(NC(=O)C1(c2cccc(F)c2)CC1)c1ccccc1
InChIInChI=1S/C19H20FNO/c1-18(2,14-7-4-3-5-8-14)21-17(22)19(11-12-19)15-9-6-10-16(20)13-15/h3-10,13H,11-12H2,1-2H3,(H,21,22)
InChIKeyKOFYWDYHIHBXDT-UHFFFAOYSA-N
MW297.37 g/mol
LogP3.91
Rot. Bonds4

About 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide

1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide (PubChem CID 139815337) has the molecular formula C19H20FNO and a molecular weight of 297.37 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide
PubChem CID139815337
Molecular FormulaC19H20FNO
Molecular Weight297.37 g/mol
Exact Mass297.15
IUPAC Name1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide
SMILESCC(C)(NC(=O)C1(c2cccc(F)c2)CC1)c1ccccc1
InChIInChI=1S/C19H20FNO/c1-18(2,14-7-4-3-5-8-14)21-17(22)19(11-12-19)15-9-6-10-16(20)13-15/h3-10,13H,11-12H2,1-2H3,(H,21,22)
InChIKeyKOFYWDYHIHBXDT-UHFFFAOYSA-N
XLogP3.91
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.37
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-[[1-(3-fluorophenyl)cyclobutanecarbonyl]amino]-2-methyl-2-phenylpropanoic acid
CID 120701332
3-[[1-(3-fluorophenyl)cyclopentanecarbonyl]amino]-2,2-dimethylpropanoic acid
CID 119249767
N-(2-ethyl-2-hydroxybutyl)-1-(3-fluorophenyl)cyclopropane-1-carboxamide
CID 111483353
5-(3-fluorophenyl)spiro[2.3]hexane-5-carboxylic acid
CID 65008380
2-[[1-(3-fluorophenyl)cyclobutanecarbonyl]amino]acetic acid
CID 119171698
1-(3-fluorophenyl)-N-(2-hydroxy-3-phenylpropyl)cyclopropane-1-carboxamide
CID 111386384
N-(2-amino-2-ethylbutyl)-1-(3-fluorophenyl)cyclobutane-1-carboxamide
CID 119639919
N-[2-(3-fluorophenyl)propan-2-yl]-2-phenylacetamide
CID 12790289
N-[[1-(3-fluorophenyl)cyclopropyl]methyl]-3-hydroxy-3-phenylbutanamide
CID 110025489
4-(3-fluorophenyl)-1,1-dioxothiane-4-carboxylic acid
CID 146681784
N-(1-bromo-2-methylpropan-2-yl)-1-phenylcyclopropane-1-carboxamide
CID 114308184
N-(3-aminobutyl)-1-(3-fluorophenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119495759

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide (CID 139815337) is 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide is CC(C)(NC(=O)C1(c2cccc(F)c2)CC1)c1ccccc1.
What is the InChIKey of 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide?
The InChIKey is KOFYWDYHIHBXDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO/c1-18(2,14-7-4-3-5-8-14)21-17(22)19(11-12-19)15-9-6-10-16(20)13-15/h3-10,13H,11-12H2,1-2H3,(H,21,22).
What are the key properties of 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide?
1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide has a molecular weight of 297.37 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-N-(2-phenylpropan-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 139815337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).