N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide

C19H28N2O — CID 119613947

IUPACN-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide
SMILESCc1ccccc1C1(C(=O)NC(CN)C2CC2)CCCCC1
InChIInChI=1S/C19H28N2O/c1-14-7-3-4-8-16(14)19(11-5-2-6-12-19)18(22)21-17(13-20)15-9-10-15/h3-4,7-8,15,17H,2,5-6,9-13,20H2,1H3,(H,21,22)
InChIKeyGMJMZAWUPBRLPQ-UHFFFAOYSA-N
MW300.45 g/mol
LogP3.05
Rot. Bonds5

About N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide

N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide (PubChem CID 119613947) has the molecular formula C19H28N2O and a molecular weight of 300.45 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide
PubChem CID119613947
Molecular FormulaC19H28N2O
Molecular Weight300.45 g/mol
Exact Mass300.22
IUPAC NameN-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide
SMILESCc1ccccc1C1(C(=O)NC(CN)C2CC2)CCCCC1
InChIInChI=1S/C19H28N2O/c1-14-7-3-4-8-16(14)19(11-5-2-6-12-19)18(22)21-17(13-20)15-9-10-15/h3-4,7-8,15,17H,2,5-6,9-13,20H2,1H3,(H,21,22)
InChIKeyGMJMZAWUPBRLPQ-UHFFFAOYSA-N
XLogP3.05
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.45
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-1-phenylcyclopentane-1-carboxamide
CID 119616687
N-(2-amino-1-cyclohexylethyl)-1-phenylcyclobutane-1-carboxamide;hydrochloride
CID 119589993
N-(2-amino-1-cyclopropylethyl)-4-(2-chlorophenyl)oxane-4-carboxamide
CID 119615938
N-(3-amino-2-methylpropyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide;hydrochloride
CID 119996800
N-(2-amino-1-cyclopropylethyl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119614549
N-(2-amino-1-cyclohexylethyl)-2-methylbenzamide;hydrochloride
CID 119588952
N-(2-amino-1-cyclohexylethyl)-4-phenyloxane-4-carboxamide;hydrochloride
CID 119591634
N-(2-amino-1-cyclohexylethyl)-2-methyl-2-(2-methylphenyl)propanamide
CID 119590911
N-(2-amino-1-cyclohexylethyl)-1-(4-chlorophenyl)cyclopropane-1-carboxamide;hydrochloride
CID 119589829
N-(2-amino-1-cyclopropylethyl)-2-(2-methylphenoxy)butanamide
CID 119617903
N-[1-[(2-amino-1-cyclopropylethyl)amino]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide
CID 119614272
N-(2-amino-1-cyclopropylethyl)-1-benzoyl-2-methylpyrrolidine-2-carboxamide
CID 119616462

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide (CID 119613947) is N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide is Cc1ccccc1C1(C(=O)NC(CN)C2CC2)CCCCC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide?
The InChIKey is GMJMZAWUPBRLPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O/c1-14-7-3-4-8-16(14)19(11-5-2-6-12-19)18(22)21-17(13-20)15-9-10-15/h3-4,7-8,15,17H,2,5-6,9-13,20H2,1H3,(H,21,22).
What are the key properties of N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide?
N-(2-amino-1-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide has a molecular weight of 300.45 g/mol, XLogP of 3.05, 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-cyclopropylethyl)-1-(2-methylphenyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 119613947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).