2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide

C12H24N2O2 — CID 107222009

IUPAC2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)N[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C12H24N2O2/c1-3-8-12(2,13)11(16)14-9-6-4-5-7-10(9)15/h9-10,15H,3-8,13H2,1-2H3,(H,14,16)/t9-,10-,12?/m1/s1
InChIKeyGGMBWDRBPKSMOF-UVTZGIPTSA-N
MW228.34 g/mol
LogP0.92
Rot. Bonds4

About 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide

2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide (PubChem CID 107222009) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide
PubChem CID107222009
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide
SMILESCCCC(C)(N)C(=O)N[C@@H]1CCCC[C@H]1O
InChIInChI=1S/C12H24N2O2/c1-3-8-12(2,13)11(16)14-9-6-4-5-7-10(9)15/h9-10,15H,3-8,13H2,1-2H3,(H,14,16)/t9-,10-,12?/m1/s1
InChIKeyGGMBWDRBPKSMOF-UVTZGIPTSA-N
XLogP0.92
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(2-hydroxycyclohexyl)-2,2,3-trimethylbutanamide
CID 65267153
2-amino-N-(2-ethylsulfanylcyclopentyl)-2-methylpentanamide
CID 103812914
3-amino-N-[(1S,2S)-2-hydroxycyclohexyl]-2,2-dimethylpropanamide
CID 94415384
2-(ethylamino)-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpropanamide
CID 94878499
3-amino-N-(2-hydroxycyclohexyl)-3-methylbutanamide
CID 64677641
3-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]-2,2-dimethylpropanamide
CID 107216789
2-amino-N-(2-imidazol-1-ylcyclopentyl)-2-methylpentanamide
CID 60847019
2-[(2-amino-2-methylbutanoyl)amino]cyclohexane-1-carboxylic acid
CID 79811925
N-[(1R,2R)-2-hydroxycyclohexyl]-2-methyl-2-piperazin-1-ylpropanamide
CID 107222046
2-amino-2-methyl-N-(oxan-3-yl)pentanamide
CID 63361438
2-cyano-N-(2-hydroxycycloheptyl)-2-methylbutanamide
CID 113394780
2-amino-2-methyl-N-(2-phenyloxolan-3-yl)pentanamide;hydrochloride
CID 119809261

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide?
The IUPAC name of 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide (CID 107222009) is 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide.
What is the SMILES notation for 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide?
The canonical SMILES for 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide is CCCC(C)(N)C(=O)N[C@@H]1CCCC[C@H]1O.
What is the InChIKey of 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide?
The InChIKey is GGMBWDRBPKSMOF-UVTZGIPTSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-3-8-12(2,13)11(16)14-9-6-4-5-7-10(9)15/h9-10,15H,3-8,13H2,1-2H3,(H,14,16)/t9-,10-,12?/m1/s1.
What are the key properties of 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide?
2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide has a molecular weight of 228.34 g/mol, XLogP of 0.92, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1R,2R)-2-hydroxycyclohexyl]-2-methylpentanamide is sourced from PubChem (CID 107222009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).