N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide

C15H22N2O — CID 79121383

IUPACN-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide
SMILESCN(C(=O)Cc1ccccc1)C1CCC(N)CC1
InChIInChI=1S/C15H22N2O/c1-17(14-9-7-13(16)8-10-14)15(18)11-12-5-3-2-4-6-12/h2-6,13-14H,7-11,16H2,1H3
InChIKeyHCULCTVZGICHKC-UHFFFAOYSA-N
MW246.35 g/mol
LogP1.96
Rot. Bonds3

About N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide

N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide (PubChem CID 79121383) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide
PubChem CID79121383
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide
SMILESCN(C(=O)Cc1ccccc1)C1CCC(N)CC1
InChIInChI=1S/C15H22N2O/c1-17(14-9-7-13(16)8-10-14)15(18)11-12-5-3-2-4-6-12/h2-6,13-14H,7-11,16H2,1H3
InChIKeyHCULCTVZGICHKC-UHFFFAOYSA-N
XLogP1.96
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-aminocyclohexyl)-2-(4-chlorophenyl)-N-methylacetamide
CID 79121866
2-(4-aminophenyl)-N-cyclopropyl-N-methylacetamide
CID 43264480
benzyl N-(4-aminocyclohexyl)-N-methylcarbamate
CID 91599052
1-(4-aminocyclohexyl)-3-benzyl-1-methylurea
CID 107652884
N-(4-aminocyclohexyl)-2-(1-benzothiophen-3-yl)-N-methylacetamide;hydrochloride
CID 154578112
2-(4-aminophenyl)-N-cyclobutyl-N-methylacetamide
CID 115739567
N-(4-aminocyclohexyl)-2-(1,2-benzoxazol-3-yl)-N-methylacetamide
CID 79113125
N-methyl-2-(4-phenylphenyl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119441133
2-[2-[[(4-aminocyclohexyl)-methylamino]methyl]phenyl]acetic acid
CID 115463093
N-[2-[cyclopentyl(methyl)amino]-2-oxoethyl]-2-phenylacetamide
CID 47128707
N-cyclopropyl-2-[4-(N'-hydroxycarbamimidoyl)phenyl]-N-methylacetamide
CID 77001320
N-(4-aminocyclohexyl)-N-methyl-2-[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]acetamide;hydrochloride
CID 170897051

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide?
The IUPAC name of N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide (CID 79121383) is N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide is CN(C(=O)Cc1ccccc1)C1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide?
The InChIKey is HCULCTVZGICHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-17(14-9-7-13(16)8-10-14)15(18)11-12-5-3-2-4-6-12/h2-6,13-14H,7-11,16H2,1H3.
What are the key properties of N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide?
N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide has a molecular weight of 246.35 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-N-methyl-2-phenylacetamide is sourced from PubChem (CID 79121383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).