2-[(1S,2S)-2-hydroxycyclohexyl]acetamide

C8H15NO2 — CID 93495946

IUPAC2-[(1S,2S)-2-hydroxycyclohexyl]acetamide
SMILESNC(=O)C[C@@H]1CCCC[C@@H]1O
InChIInChI=1S/C8H15NO2/c9-8(11)5-6-3-1-2-4-7(6)10/h6-7,10H,1-5H2,(H2,9,11)/t6-,7-/m0/s1
InChIKeyHYVQVNDQLSRHQH-BQBZGAKWSA-N
MW157.21 g/mol
LogP0.41
Rot. Bonds2

About 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide

2-[(1S,2S)-2-hydroxycyclohexyl]acetamide (PubChem CID 93495946) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide.

Molecular Properties

Compound Name2-[(1S,2S)-2-hydroxycyclohexyl]acetamide
PubChem CID93495946
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name2-[(1S,2S)-2-hydroxycyclohexyl]acetamide
SMILESNC(=O)C[C@@H]1CCCC[C@@H]1O
InChIInChI=1S/C8H15NO2/c9-8(11)5-6-3-1-2-4-7(6)10/h6-7,10H,1-5H2,(H2,9,11)/t6-,7-/m0/s1
InChIKeyHYVQVNDQLSRHQH-BQBZGAKWSA-N
XLogP0.41
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-hydroxycycloheptyl)acetohydrazide
CID 130147718
2-[(1S,2R)-2-hydroxycyclopentyl]acetic acid
CID 22800145
2-[2-(2-oxoethyl)cyclohexyl]acetamide
CID 87760374
2-cyclodecylacetamide
CID 150110792
[(1R,2S)-2-hydroxycyclopentyl]methyl acetate
CID 10986511
trans-(1R,2R)-2-(2-methylprop-2-enyl)cyclohexan-1-ol
CID 71351318
trans-(1S,2S)-2-(aminomethyl)cyclooctan-1-ol;hydrochloride
CID 2725085
2-[(3R,4R)-4-hydroxypyrrolidin-3-yl]acetamide
CID 91590285
1-amino-N-[(2-hydroxycyclohexyl)methyl]cyclobutane-1-carboxamide
CID 81168615
1-(aminomethyl)-N-[(2-hydroxycyclohexyl)methyl]cyclobutane-1-carboxamide
CID 115448612
trans-(1S,2S)-2-(aminomethyl)cyclopentan-1-ol;hydrochloride
CID 134691166
cis-(1R,2S)-2-(2-hydroxyethyl)cyclohexan-1-ol
CID 71357650

Frequently Asked Questions

What is the IUPAC name of 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide?
The IUPAC name of 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide (CID 93495946) is 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide.
What is the SMILES notation for 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide?
The canonical SMILES for 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide is NC(=O)C[C@@H]1CCCC[C@@H]1O.
What is the InChIKey of 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide?
The InChIKey is HYVQVNDQLSRHQH-BQBZGAKWSA-N. The full InChI is InChI=1S/C8H15NO2/c9-8(11)5-6-3-1-2-4-7(6)10/h6-7,10H,1-5H2,(H2,9,11)/t6-,7-/m0/s1.
What are the key properties of 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide?
2-[(1S,2S)-2-hydroxycyclohexyl]acetamide has a molecular weight of 157.21 g/mol, XLogP of 0.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S,2S)-2-hydroxycyclohexyl]acetamide is sourced from PubChem (CID 93495946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).