N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide

C13H25NO2 — CID 95292122

IUPACN-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC[C@H](O)C1CCCCC1
InChIInChI=1S/C13H25NO2/c1-13(2,3)12(16)14-9-11(15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)/t11-/m0/s1
InChIKeyMEMFNBRMCHBAMW-NSHDSACASA-N
MW227.35 g/mol
LogP2.09
Rot. Bonds3

About N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide

N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide (PubChem CID 95292122) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide
PubChem CID95292122
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC NameN-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)C(=O)NC[C@H](O)C1CCCCC1
InChIInChI=1S/C13H25NO2/c1-13(2,3)12(16)14-9-11(15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)/t11-/m0/s1
InChIKeyMEMFNBRMCHBAMW-NSHDSACASA-N
XLogP2.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-N-(2-cyclopropyl-2-hydroxyethyl)-2-methylpropanamide
CID 63297255
2-amino-N-(2-cyclohexyl-2-hydroxyethyl)-2-phenylpropanamide
CID 120589210
tert-butyl N-(2-cyclobutyl-2-hydroxyethyl)carbamate
CID 116861144
N-(2-cyclopentyl-2-hydroxyethyl)-3-methylbutanamide
CID 111425656
1-cyclohexyl-3-(2-cyclopropyl-2-hydroxyethyl)urea
CID 63237441
N-(2-cyclopentyl-2-hydroxyethyl)-2-(4-fluorophenoxy)-2-methylpropanamide
CID 111426344
2-amino-N-(2-cyclopropyl-2-hydroxyethyl)-2-ethylbutanamide
CID 79814450
1-cyclohexyl-2-(3,3-dimethylbutan-2-ylamino)ethanol
CID 115716454
1-tert-butyl-3-(2-cyclopropyl-2-hydroxyethyl)urea
CID 63298478
N-(2-cyclopentyl-2-hydroxyethyl)-N'-cyclopropyloxamide
CID 111425530
3-cyclopentyl-N-[2-[(2-cyclopentyl-2-hydroxyethyl)amino]-2-oxoethyl]propanamide
CID 111426276
3-amino-N-(2-cyclohexyl-2-hydroxyethyl)propanamide;hydrochloride
CID 119293866

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide (CID 95292122) is N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide is CC(C)(C)C(=O)NC[C@H](O)C1CCCCC1.
What is the InChIKey of N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide?
The InChIKey is MEMFNBRMCHBAMW-NSHDSACASA-N. The full InChI is InChI=1S/C13H25NO2/c1-13(2,3)12(16)14-9-11(15)10-7-5-4-6-8-10/h10-11,15H,4-9H2,1-3H3,(H,14,16)/t11-/m0/s1.
What are the key properties of N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide?
N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide has a molecular weight of 227.35 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-cyclohexyl-2-hydroxyethyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 95292122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).