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

C12H24N2O2 — CID 102632066

IUPAC3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide
SMILESCN(C(=O)CC(C)(C)N)C1CCCCC1O
InChIInChI=1S/C12H24N2O2/c1-12(2,13)8-11(16)14(3)9-6-4-5-7-10(9)15/h9-10,15H,4-8,13H2,1-3H3
InChIKeyNFOGUGGJPABSMG-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.88
Rot. Bonds3

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

3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide (PubChem CID 102632066) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide
PubChem CID102632066
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide
SMILESCN(C(=O)CC(C)(C)N)C1CCCCC1O
InChIInChI=1S/C12H24N2O2/c1-12(2,13)8-11(16)14(3)9-6-4-5-7-10(9)15/h9-10,15H,4-8,13H2,1-3H3
InChIKeyNFOGUGGJPABSMG-UHFFFAOYSA-N
XLogP0.88
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2-hydroxycyclohexyl)-N,2-dimethylbutanamide
CID 102632097
2-tert-butylsulfanyl-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102635096
2-(1-aminocyclobutyl)-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102632099
N-(2-hydroxycyclohexyl)-2-methoxy-N-methylacetamide
CID 102634610
2-cyclobutyl-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 103164780
2-cycloheptyl-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102635605
2-bromo-N-(2-hydroxycyclohexyl)-N,2-dimethylpropanamide
CID 102631757
2-[(2-amino-2-methylpropyl)-methylamino]cyclohexan-1-ol;hydrochloride
CID 130878660
2-(ethylamino)-N-(2-hydroxycyclohexyl)-N-methylacetamide
CID 102631990
2-amino-N-[2-[(2-hydroxycyclohexyl)-methylamino]-2-oxoethyl]acetamide
CID 102631962
2-(4-ethylphenyl)-N-[(1R,2S)-2-hydroxycyclohexyl]-N-methylacetamide
CID 95397472
5-amino-N-(2-hydroxycyclohexyl)-N,4-dimethylpentanamide
CID 102631912

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide?
The IUPAC name of 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide (CID 102632066) is 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide.
What is the SMILES notation for 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide?
The canonical SMILES for 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide is CN(C(=O)CC(C)(C)N)C1CCCCC1O.
What is the InChIKey of 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide?
The InChIKey is NFOGUGGJPABSMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2,13)8-11(16)14(3)9-6-4-5-7-10(9)15/h9-10,15H,4-8,13H2,1-3H3.
What are the key properties of 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide?
3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide has a molecular weight of 228.34 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxycyclohexyl)-N,3-dimethylbutanamide is sourced from PubChem (CID 102632066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).