N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide

C12H23NO2 — CID 103429431

IUPACN-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide
SMILESCC1CCCC(NC(=O)C(C)(C)O)C1C
InChIInChI=1S/C12H23NO2/c1-8-6-5-7-10(9(8)2)13-11(14)12(3,4)15/h8-10,15H,5-7H2,1-4H3,(H,13,14)
InChIKeyKAUAJMCKCHWUIN-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.70
Rot. Bonds2

About N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide

N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide (PubChem CID 103429431) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide
PubChem CID103429431
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide
SMILESCC1CCCC(NC(=O)C(C)(C)O)C1C
InChIInChI=1S/C12H23NO2/c1-8-6-5-7-10(9(8)2)13-11(14)12(3,4)15/h8-10,15H,5-7H2,1-4H3,(H,13,14)
InChIKeyKAUAJMCKCHWUIN-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-cyclopropyl-N-(2,3-dimethylcyclohexyl)propanamide
CID 54924834
1-tert-butyl-3-(2,3-dimethylcyclohexyl)urea
CID 115569990
N-(2,3-dimethylcyclohexyl)-2-methyl-2-piperazin-1-ylpropanamide
CID 80548354
2-[(2,3-dimethylcyclohexyl)amino]-2-oxoacetic acid
CID 43445011
2-amino-N-(2,3-dimethylcyclohexyl)-2-phenylpropanamide;hydrochloride
CID 120607906
tert-butyl 4-[(2,3-dimethylcyclohexyl)amino]-4-oxobutanoate
CID 106706973
1-(2,3-dimethylcyclohexyl)-3-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)urea
CID 111437886
N-(2,3-dimethylcyclohexyl)-4-[(E)-4,4-dimethylpent-2-en-2-yl]benzamide
CID 59811280
4-[(2,3-dimethylcyclohexyl)amino]-2,3-dimethyl-4-oxobutanoic acid
CID 103496143
(2S)-2-amino-N-(2,3-dimethylcyclohexyl)-3-methylbutanamide
CID 61148874
N-[[(1R,2S,3R)-2,3-dimethylcyclohexyl]carbamothioyl]cyclopropanecarboxamide
CID 7858471
N-(2,3-dimethylcyclohexyl)-2-(propan-2-ylamino)acetamide
CID 60648714

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide?
The IUPAC name of N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide (CID 103429431) is N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide.
What is the SMILES notation for N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide?
The canonical SMILES for N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide is CC1CCCC(NC(=O)C(C)(C)O)C1C.
What is the InChIKey of N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide?
The InChIKey is KAUAJMCKCHWUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-8-6-5-7-10(9(8)2)13-11(14)12(3,4)15/h8-10,15H,5-7H2,1-4H3,(H,13,14).
What are the key properties of N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide?
N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 1.70, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclohexyl)-2-hydroxy-2-methylpropanamide is sourced from PubChem (CID 103429431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).