2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide

C13H18N2O — CID 62398147

IUPAC2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNC1CC1C
InChIInChI=1S/C13H18N2O/c1-9-5-3-4-6-11(9)15-13(16)8-14-12-7-10(12)2/h3-6,10,12,14H,7-8H2,1-2H3,(H,15,16)
InChIKeyCEJCBPRTGHUVRA-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.93
Rot. Bonds4

About 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide

2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide (PubChem CID 62398147) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide
PubChem CID62398147
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CNC1CC1C
InChIInChI=1S/C13H18N2O/c1-9-5-3-4-6-11(9)15-13(16)8-14-12-7-10(12)2/h3-6,10,12,14H,7-8H2,1-2H3,(H,15,16)
InChIKeyCEJCBPRTGHUVRA-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3-methylcyclopentyl)methylamino]-N-(2-methylphenyl)acetamide
CID 107412858
N-(2-bromophenyl)-2-[(2,4-dimethylcyclohexyl)amino]acetamide
CID 63994904
2-methyl-N-[2-(2-methylanilino)-2-oxoethyl]-N-propylcyclopropane-1-carboxamide
CID 42990004
2-methyl-N-[2-(2-methylanilino)-2-oxoethyl]benzamide
CID 21383192
N-(2-methylphenyl)-3-oxobutanamide
CID 7154
2-[(2,3-dimethylcyclopentyl)amino]-N-(2-methoxyphenyl)acetamide
CID 64909122
2-[cycloheptyl(methyl)amino]-N-(2-methylphenyl)acetamide
CID 16577693
3-(3,5-dimethylpiperidin-1-ium-1-yl)-N-(2-methylphenyl)propanamide
CID 4742360
3-[(3R,5R)-3,5-dimethylpiperidin-1-ium-1-yl]-N-(2-methylphenyl)propanamide
CID 7334329
N-(2-methylphenyl)propanamide;molecular hydrogen
CID 143153627
methyl N-[2-(2-methylanilino)-2-oxoethyl]carbamate
CID 112996068
2-amino-N-[2-(2-methylanilino)-2-oxoethyl]acetamide
CID 60848997

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide (CID 62398147) is 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CNC1CC1C.
What is the InChIKey of 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide?
The InChIKey is CEJCBPRTGHUVRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-9-5-3-4-6-11(9)15-13(16)8-14-12-7-10(12)2/h3-6,10,12,14H,7-8H2,1-2H3,(H,15,16).
What are the key properties of 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide?
2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide has a molecular weight of 218.30 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylcyclopropyl)amino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 62398147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).