N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide

C21H24N2O2 — CID 157276717

IUPACN-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(C2CC2C(=O)N(C)CC(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C21H24N2O2/c1-15-9-11-16(12-10-15)18-13-19(18)21(25)22(2)14-20(24)23(3)17-7-5-4-6-8-17/h4-12,18-19H,13-14H2,1-3H3
InChIKeyTXXSXNKFZOYOQC-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.22
Rot. Bonds5

About N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide

N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide (PubChem CID 157276717) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide
PubChem CID157276717
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC NameN-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide
SMILESCc1ccc(C2CC2C(=O)N(C)CC(=O)N(C)c2ccccc2)cc1
InChIInChI=1S/C21H24N2O2/c1-15-9-11-16(12-10-15)18-13-19(18)21(25)22(2)14-20(24)23(3)17-7-5-4-6-8-17/h4-12,18-19H,13-14H2,1-3H3
InChIKeyTXXSXNKFZOYOQC-UHFFFAOYSA-N
XLogP3.22
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cis-(1R,2S)-2-(4-bromophenyl)-N-[2-(dimethylamino)-2-oxoethyl]-N-methylcyclopropane-1-carboxamide
CID 95595198
2-(4-methylphenyl)cyclopropane-1-carboxylic acid
CID 23423017
N-(2-hydroxypropyl)-N-methyl-2-phenylcyclopropane-1-carboxamide
CID 79543844
trans-(1S,2S)-2-(4-fluorophenyl)-N-methyl-N-[(4-phenylphenyl)methyl]cyclopropane-1-carboxamide
CID 97061376
N-methyl-N-[(6-methyl-2-pyridinyl)methyl]-2-phenylcyclopropane-1-carboxamide
CID 142111486
1-[(1R,2S)-2-(4-methylphenyl)cyclopropyl]ethanone
CID 39057983
2-[acetyl(cyclopropyl)amino]-N-methyl-N-phenylacetamide
CID 113158391
trans-(1S,2S)-N-[(2S)-butan-2-yl]-N-[(2R)-butan-2-yl]-2-phenylcyclopropane-1-carboxamide
CID 98329771
cis-(1R,2S)-N,N-bis[(2S)-butan-2-yl]-2-phenylcyclopropane-1-carboxamide
CID 40584792
trans-(1R,2R)-2-(4-bromophenyl)-N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)cyclopropane-1-carboxamide
CID 52528149
2-[methyl-[2-(N-methylanilino)-2-oxoethyl]amino]acetic acid
CID 43442375
1-benzyl-3-[[(1R,2R)-2-(4-methylphenyl)cyclopropanecarbonyl]amino]thiourea
CID 843472

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide (CID 157276717) is N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide is Cc1ccc(C2CC2C(=O)N(C)CC(=O)N(C)c2ccccc2)cc1.
What is the InChIKey of N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide?
The InChIKey is TXXSXNKFZOYOQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c1-15-9-11-16(12-10-15)18-13-19(18)21(25)22(2)14-20(24)23(3)17-7-5-4-6-8-17/h4-12,18-19H,13-14H2,1-3H3.
What are the key properties of N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide?
N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide has a molecular weight of 336.44 g/mol, XLogP of 3.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(N-methylanilino)-2-oxoethyl]-2-(4-methylphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 157276717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).