N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide

C12H23NO2 — CID 165463094

IUPACN-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCCC1CCCCC1O
InChIInChI=1S/C12H23NO2/c1-9(2)12(15)13-8-7-10-5-3-4-6-11(10)14/h9-11,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyADKCLZOZGRXMBI-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.70
Rot. Bonds4

About N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide

N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide (PubChem CID 165463094) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide
PubChem CID165463094
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC NameN-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide
SMILESCC(C)C(=O)NCCC1CCCCC1O
InChIInChI=1S/C12H23NO2/c1-9(2)12(15)13-8-7-10-5-3-4-6-11(10)14/h9-11,14H,3-8H2,1-2H3,(H,13,15)
InChIKeyADKCLZOZGRXMBI-UHFFFAOYSA-N
XLogP1.70
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
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

N-[2-(2-hydroxycyclohexyl)ethyl]-2,3-dimethylbutanamide
CID 165488206
N-[2-[(1S,2R)-2-hydroxycyclohexyl]ethyl]prop-2-enamide
CID 166415844
2-chloro-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 64929109
(2R)-2-amino-N-[(2-hydroxycyclohexyl)methyl]propanamide
CID 79001441
5-[(1S,2S)-2-hydroxycyclohexyl]-3-methylpentan-2-one
CID 59045631
N-[2-[acetyl(cyclopentyl)amino]ethyl]-2-methylpropanamide
CID 113052772
N-[(2-hydroxycyclohexyl)methyl]-3-methyl-2-sulfanylbutanamide
CID 107031039
N-[2-(7-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-yl)ethyl]-2-methylpropanamide
CID 174325247
(2S)-N-[3-[(1R,2S)-2-hydroxycyclopentyl]propyl]-2-phenylpropanamide
CID 99856024
N-(cyclopentylmethyl)-2-methylpropanamide
CID 58333395
N-butyl-2-[(2-hydroxycyclohexyl)methylamino]propanamide
CID 64913889
N-[2-(cyclododecylamino)ethyl]-2-methylpropanamide
CID 28552099

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide?
The IUPAC name of N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide (CID 165463094) is N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide.
What is the SMILES notation for N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide?
The canonical SMILES for N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide is CC(C)C(=O)NCCC1CCCCC1O.
What is the InChIKey of N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide?
The InChIKey is ADKCLZOZGRXMBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-9(2)12(15)13-8-7-10-5-3-4-6-11(10)14/h9-11,14H,3-8H2,1-2H3,(H,13,15).
What are the key properties of N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide?
N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide has a molecular weight of 213.32 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-hydroxycyclohexyl)ethyl]-2-methylpropanamide is sourced from PubChem (CID 165463094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).