N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide

C12H24N2O2 — CID 103021379

IUPACN-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide
SMILESCOC(C)(C)CC(=O)NC1CCCCC1N
InChIInChI=1S/C12H24N2O2/c1-12(2,16-3)8-11(15)14-10-7-5-4-6-9(10)13/h9-10H,4-8,13H2,1-3H3,(H,14,15)
InChIKeyATNZOTFCDUCZSZ-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.19
Rot. Bonds4

About N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide

N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide (PubChem CID 103021379) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide.

Molecular Properties

Compound NameN-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide
PubChem CID103021379
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide
SMILESCOC(C)(C)CC(=O)NC1CCCCC1N
InChIInChI=1S/C12H24N2O2/c1-12(2,16-3)8-11(15)14-10-7-5-4-6-9(10)13/h9-10H,4-8,13H2,1-3H3,(H,14,15)
InChIKeyATNZOTFCDUCZSZ-UHFFFAOYSA-N
XLogP1.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(1R,2R)-2-aminocyclohexyl]-3,3,3-trifluoropropanamide
CID 93451955
N-(2-aminocyclohexyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112603334
N-(2-aminocyclohexyl)propanamide
CID 61036997
4-[(2-aminocyclohexyl)amino]-2,2-diethyl-4-oxobutanoic acid
CID 61403433
N-(2-aminocyclohexyl)-2-(methylamino)acetamide
CID 130622235
N-[(1R,2R)-2-aminocyclohexyl]-2-methylsulfanylacetamide
CID 93452012
N-[(1R,2R)-2-aminocyclohexyl]-3-ethoxypropanamide
CID 103805745
N-(2-aminocycloheptyl)-2,2-dimethylbutanamide
CID 63258190
1-cycloheptyl-3-methoxy-3-methylbutan-1-one
CID 103023457
N-(2-aminocyclopentyl)-2-cyclohexylacetamide
CID 63251405
N-[(1R,2R)-2-aminocyclohexyl]but-3-enamide
CID 94547428
tert-butyl N-[(1S,2S)-2-aminocyclopentyl]carbamate
CID 17040218

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide?
The IUPAC name of N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide (CID 103021379) is N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide.
What is the SMILES notation for N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide?
The canonical SMILES for N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide is COC(C)(C)CC(=O)NC1CCCCC1N.
What is the InChIKey of N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide?
The InChIKey is ATNZOTFCDUCZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2,16-3)8-11(15)14-10-7-5-4-6-9(10)13/h9-10H,4-8,13H2,1-3H3,(H,14,15).
What are the key properties of N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide?
N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide has a molecular weight of 228.34 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclohexyl)-3-methoxy-3-methylbutanamide is sourced from PubChem (CID 103021379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).