2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide

C12H24N2O2 — CID 68925169

IUPAC2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)C(N)C(=O)NC1CCCCC1O
InChIInChI=1S/C12H24N2O2/c1-12(2,3)10(13)11(16)14-8-6-4-5-7-9(8)15/h8-10,15H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyNUMPUVUHFTUNNS-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.78
Rot. Bonds2

About 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide

2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide (PubChem CID 68925169) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide
PubChem CID68925169
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide
SMILESCC(C)(C)C(N)C(=O)NC1CCCCC1O
InChIInChI=1S/C12H24N2O2/c1-12(2,3)10(13)11(16)14-8-6-4-5-7-9(8)15/h8-10,15H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyNUMPUVUHFTUNNS-UHFFFAOYSA-N
XLogP0.78
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.78
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide 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

(2S)-2-amino-3,3-dimethyl-N-[2-(trifluoromethyl)cyclohexyl]butanamide
CID 61178090
2-[(2-amino-3,3-dimethylbutanoyl)amino]cyclopentane-1-carboxylic acid
CID 77053196
2-amino-N-[(1S,2S)-2-hydroxycyclohexyl]butanamide
CID 107221502
2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide
CID 76934435
2-(aminomethyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4,4-dimethylpentanamide
CID 107472961
3-amino-N-(2-hydroxycyclohexyl)-2,2,3-trimethylbutanamide
CID 65267153
(2S)-2-amino-N-cyclopropyl-3,3-dimethylbutanamide;hydrochloride
CID 66951838
(2R)-2-amino-N-(2,3-dimethylcyclopentyl)-3,3-dimethylbutanamide
CID 103930053
3-amino-N-(2-hydroxycyclohexyl)-3-methylbutanamide
CID 64677641
(2S)-2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-3-methylpentanamide
CID 107221962
2-(carbamoylamino)-N-[(1R,2R)-2-hydroxycyclohexyl]-3-methylbutanamide
CID 104931679
N-[(1R,2R)-2-hydroxycyclopentyl]-2-methylpropanamide
CID 138722563

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide (CID 68925169) is 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide is CC(C)(C)C(N)C(=O)NC1CCCCC1O.
What is the InChIKey of 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide?
The InChIKey is NUMPUVUHFTUNNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2,3)10(13)11(16)14-8-6-4-5-7-9(8)15/h8-10,15H,4-7,13H2,1-3H3,(H,14,16).
What are the key properties of 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide?
2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide has a molecular weight of 228.34 g/mol, XLogP of 0.78, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxycyclohexyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 68925169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).