N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide

C19H21NO — CID 134028500

IUPACN-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide
SMILESCc1ccccc1CN(C)C(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C19H21NO/c1-15-8-6-7-9-16(15)14-20(2)18(21)19(12-13-19)17-10-4-3-5-11-17/h3-11H,12-14H2,1-2H3
InChIKeyWBMJWDSJUXARMX-UHFFFAOYSA-N
MW279.38 g/mol
LogP3.69
Rot. Bonds4

About N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide

N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide (PubChem CID 134028500) has the molecular formula C19H21NO and a molecular weight of 279.38 g/mol. Its IUPAC name is N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide
PubChem CID134028500
Molecular FormulaC19H21NO
Molecular Weight279.38 g/mol
Exact Mass279.16
IUPAC NameN-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide
SMILESCc1ccccc1CN(C)C(=O)C1(c2ccccc2)CC1
InChIInChI=1S/C19H21NO/c1-15-8-6-7-9-16(15)14-20(2)18(21)19(12-13-19)17-10-4-3-5-11-17/h3-11H,12-14H2,1-2H3
InChIKeyWBMJWDSJUXARMX-UHFFFAOYSA-N
XLogP3.69
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(2-bromophenyl)methyl]-N-methyl-1-phenylcyclopropane-1-carboxamide
CID 60630831
N-(2-hydroxypropyl)-N-methyl-1-phenylcyclopropane-1-carboxamide
CID 62335163
N-(2-aminoethyl)-N-methyl-1-phenylcyclopropane-1-carboxamide
CID 62878656
N-[(2,3-dichlorophenyl)methyl]-N-methyl-4-phenyloxane-4-carboxamide
CID 39913975
1-ethylsulfonyl-N-[(2-fluorophenyl)methyl]-N-methyl-4-phenylpiperidine-4-carboxamide
CID 78816390
1-(4-bromophenyl)-N-[(2-methoxyphenyl)methyl]-N-methylcyclopropane-1-carboxamide
CID 55521659
2-methyl-3-[methyl-(1-phenylcyclopropanecarbonyl)amino]propanoic acid
CID 55008067
4-methoxy-N-methyl-N-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 119681705
N-methyl-1-phenylcyclopropane-1-carbohydrazide
CID 116846008
N-[(4-bromophenyl)methyl]-N-methyl-1-phenylcyclobutane-1-carboxamide
CID 55429305
N-methyl-1-phenyl-N-[(3,4,5-trimethoxyphenyl)methyl]cyclopropane-1-carboxamide
CID 100788749
3-[methyl-[(2-methylphenyl)methyl]amino]-3-oxopropanoic acid
CID 62231590

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide?
The IUPAC name of N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide (CID 134028500) is N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide.
What is the SMILES notation for N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide?
The canonical SMILES for N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide is Cc1ccccc1CN(C)C(=O)C1(c2ccccc2)CC1.
What is the InChIKey of N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide?
The InChIKey is WBMJWDSJUXARMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO/c1-15-8-6-7-9-16(15)14-20(2)18(21)19(12-13-19)17-10-4-3-5-11-17/h3-11H,12-14H2,1-2H3.
What are the key properties of N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide?
N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 3.69, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2-methylphenyl)methyl]-1-phenylcyclopropane-1-carboxamide is sourced from PubChem (CID 134028500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).