N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide

C18H20N2O — CID 28660333

IUPACN-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(NCCc2ccccc2)cc1)C1CC1
InChIInChI=1S/C18H20N2O/c21-18(15-6-7-15)20-17-10-8-16(9-11-17)19-13-12-14-4-2-1-3-5-14/h1-5,8-11,15,19H,6-7,12-13H2,(H,20,21)
InChIKeyDIDAFOBARNXMMN-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.69
Rot. Bonds6

About N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide

N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide (PubChem CID 28660333) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide
PubChem CID28660333
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide
SMILESO=C(Nc1ccc(NCCc2ccccc2)cc1)C1CC1
InChIInChI=1S/C18H20N2O/c21-18(15-6-7-15)20-17-10-8-16(9-11-17)19-13-12-14-4-2-1-3-5-14/h1-5,8-11,15,19H,6-7,12-13H2,(H,20,21)
InChIKeyDIDAFOBARNXMMN-UHFFFAOYSA-N
XLogP3.69
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[2-(3-methoxyphenyl)ethylamino]phenyl]cyclopropanecarboxamide
CID 112983563
N-[4-(2-phenylethoxy)phenyl]cyclopropanecarboxamide
CID 15943236
4-N-(3,4-dimethylphenyl)-1-N-(2-phenylethyl)cyclohexane-1,4-dicarboxamide
CID 109148979
N-[4-[2-(cyclopropylamino)ethyl]phenyl]cyclopropanecarboxamide
CID 82262226
N-[3-(2-phenylethylcarbamoylamino)phenyl]cyclopropanecarboxamide
CID 38215909
4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150302
N-[4-[2-(3-methoxyphenyl)ethylamino]phenyl]cyclohexanecarboxamide
CID 112983566
N-[4-(2-methoxyethylamino)phenyl]cyclopropanecarboxamide
CID 112980891
4-N-(2,6-difluorophenyl)-1-N-(2-phenylethyl)cyclohexane-1,4-dicarboxamide
CID 109149014
N-[4-[2-(2-fluorophenyl)ethylamino]phenyl]oxane-4-carboxamide
CID 112983418
4-N-(3-methylphenyl)-1-N-(2-phenylethyl)cyclohexane-1,4-dicarboxamide
CID 109148972
N-[4-[[(2S)-2-amino-3-phenylpropanoyl]amino]phenyl]cyclopropanecarboxamide
CID 119276864

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide?
The IUPAC name of N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide (CID 28660333) is N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide?
The canonical SMILES for N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide is O=C(Nc1ccc(NCCc2ccccc2)cc1)C1CC1.
What is the InChIKey of N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide?
The InChIKey is DIDAFOBARNXMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c21-18(15-6-7-15)20-17-10-8-16(9-11-17)19-13-12-14-4-2-1-3-5-14/h1-5,8-11,15,19H,6-7,12-13H2,(H,20,21).
What are the key properties of N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide?
N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide has a molecular weight of 280.37 g/mol, XLogP of 3.69, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-phenylethylamino)phenyl]cyclopropanecarboxamide is sourced from PubChem (CID 28660333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).