N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide

C16H24N2O2 — CID 119404004

IUPACN-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)NCC1(N)CCCCC1
InChIInChI=1S/C16H24N2O2/c1-20-14-8-4-3-7-13(14)11-15(19)18-12-16(17)9-5-2-6-10-16/h3-4,7-8H,2,5-6,9-12,17H2,1H3,(H,18,19)
InChIKeyIEUGQECYHMESKC-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.02
Rot. Bonds5

About N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide

N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide (PubChem CID 119404004) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide
PubChem CID119404004
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1CC(=O)NCC1(N)CCCCC1
InChIInChI=1S/C16H24N2O2/c1-20-14-8-4-3-7-13(14)11-15(19)18-12-16(17)9-5-2-6-10-16/h3-4,7-8H,2,5-6,9-12,17H2,1H3,(H,18,19)
InChIKeyIEUGQECYHMESKC-UHFFFAOYSA-N
XLogP2.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-aminocyclohexyl)methyl]-2-(2-methylphenyl)acetamide;hydrochloride
CID 119259809
N-[(1-aminocyclohexyl)methyl]-2-(3,4-dimethoxyphenyl)acetamide;hydrochloride
CID 119404276
2-(2-methoxyphenyl)-N-[[1-(2-methoxyphenyl)cyclobutyl]methyl]acetamide
CID 110446469
N-(2-amino-2-methylpropyl)-2-(2-methoxyphenyl)acetamide
CID 81482461
N-ethyl-2-(2-methoxyphenyl)acetamide
CID 3376729
N-[(1-aminocyclohexyl)methyl]-2-(2,4-difluorophenyl)acetamide
CID 119404549
2-(1-aminocyclohexyl)-N-(2-methoxyphenyl)acetamide
CID 64685514
N-(2-hydroxyethyl)-2-(2-methoxyphenyl)acetamide
CID 43388864
N-[(1-hydroxycyclopentyl)methyl]-2-(2-propan-2-yloxyphenyl)acetamide
CID 111331235
1-amino-N-[(2,3-dimethoxyphenyl)methyl]cyclohexane-1-carboxamide
CID 119281357
N-[(1-aminocyclohexyl)methyl]-3-bromo-4-methoxybenzamide;hydrochloride
CID 119404702
1-[(2-methoxyphenoxy)methyl]cyclohexan-1-amine
CID 84698885

Frequently Asked Questions

What is the IUPAC name of N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide?
The IUPAC name of N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide (CID 119404004) is N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide.
What is the SMILES notation for N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide?
The canonical SMILES for N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide is COc1ccccc1CC(=O)NCC1(N)CCCCC1.
What is the InChIKey of N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide?
The InChIKey is IEUGQECYHMESKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-20-14-8-4-3-7-13(14)11-15(19)18-12-16(17)9-5-2-6-10-16/h3-4,7-8H,2,5-6,9-12,17H2,1H3,(H,18,19).
What are the key properties of N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide?
N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-aminocyclohexyl)methyl]-2-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 119404004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).