N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide

C19H30N2O — CID 119590911

IUPACN-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide
SMILESCc1ccccc1C(C)(C)C(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C19H30N2O/c1-14-9-7-8-12-16(14)19(2,3)18(22)21-17(13-20)15-10-5-4-6-11-15/h7-9,12,15,17H,4-6,10-11,13,20H2,1-3H3,(H,21,22)
InChIKeyZFDAHPALRZETGS-UHFFFAOYSA-N
MW302.46 g/mol
LogP3.30
Rot. Bonds5

About N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide

N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide (PubChem CID 119590911) has the molecular formula C19H30N2O and a molecular weight of 302.46 g/mol. Its IUPAC name is N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide
PubChem CID119590911
Molecular FormulaC19H30N2O
Molecular Weight302.46 g/mol
Exact Mass302.24
IUPAC NameN-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide
SMILESCc1ccccc1C(C)(C)C(=O)NC(CN)C1CCCCC1
InChIInChI=1S/C19H30N2O/c1-14-9-7-8-12-16(14)19(2,3)18(22)21-17(13-20)15-10-5-4-6-11-15/h7-9,12,15,17H,4-6,10-11,13,20H2,1-3H3,(H,21,22)
InChIKeyZFDAHPALRZETGS-UHFFFAOYSA-N
XLogP3.30
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.46
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-cyclohexylethyl)-2-methylbenzamide;hydrochloride
CID 119588952
N-(2-amino-1-cyclohexylethyl)-2-(3,4-dimethoxyphenyl)-2-methylpropanamide;hydrochloride
CID 119589762
N-(2-amino-1-cyclohexylethyl)-3-methyl-3-phenylbutanamide;hydrochloride
CID 119591290
N-(2-amino-1-cyclopropylethyl)-2-(3-chlorophenyl)-2-methylpropanamide
CID 119613199
N-(2-amino-1-cyclopentylethyl)-2-(trifluoromethyl)benzamide
CID 106737225
N-(2-amino-1-cyclopropylethyl)-2-(4-chlorophenyl)-2-methylpropanamide
CID 119612723
N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide
CID 119613947
N-(2-amino-1-cyclopentylethyl)-2,2,2-trifluoroacetamide
CID 106737372
N-(2-amino-1-cyclohexylethyl)-2-chlorobenzamide
CID 81487183
N-(2-amino-1-cyclohexylethyl)-2-methyl-2,3-dihydro-1,4-benzodioxine-3-carboxamide
CID 119589875
N-(2-amino-1-cyclohexylethyl)-2-iodobenzamide
CID 81487660
N-(2-amino-1-cyclohexylethyl)-2-propan-2-ylsulfonylbenzamide
CID 119591550

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide?
The IUPAC name of N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide (CID 119590911) is N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide.
What is the SMILES notation for N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide?
The canonical SMILES for N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide is Cc1ccccc1C(C)(C)C(=O)NC(CN)C1CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide?
The InChIKey is ZFDAHPALRZETGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O/c1-14-9-7-8-12-16(14)19(2,3)18(22)21-17(13-20)15-10-5-4-6-11-15/h7-9,12,15,17H,4-6,10-11,13,20H2,1-3H3,(H,21,22).
What are the key properties of N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide?
N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide has a molecular weight of 302.46 g/mol, XLogP of 3.30, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide is sourced from PubChem (CID 119590911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).