(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide

C10H19NO2 — CID 70253137

IUPAC(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)[C@H](C)O)CC1
InChIInChI=1S/C10H19NO2/c1-7-3-5-9(6-4-7)11-10(13)8(2)12/h7-9,12H,3-6H2,1-2H3,(H,11,13)/t7?,8-,9?/m0/s1
InChIKeyVDQYRSUWHIGQAP-MGURRDGZSA-N
MW185.27 g/mol
LogP1.06
Rot. Bonds2

About (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide

(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide (PubChem CID 70253137) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide
PubChem CID70253137
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide
SMILESCC1CCC(NC(=O)[C@H](C)O)CC1
InChIInChI=1S/C10H19NO2/c1-7-3-5-9(6-4-7)11-10(13)8(2)12/h7-9,12H,3-6H2,1-2H3,(H,11,13)/t7?,8-,9?/m0/s1
InChIKeyVDQYRSUWHIGQAP-MGURRDGZSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide?
The IUPAC name of (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide (CID 70253137) is (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide.
What is the SMILES notation for (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide?
The canonical SMILES for (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide is CC1CCC(NC(=O)[C@H](C)O)CC1.
What is the InChIKey of (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide?
The InChIKey is VDQYRSUWHIGQAP-MGURRDGZSA-N. The full InChI is InChI=1S/C10H19NO2/c1-7-3-5-9(6-4-7)11-10(13)8(2)12/h7-9,12H,3-6H2,1-2H3,(H,11,13)/t7?,8-,9?/m0/s1.
What are the key properties of (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide?
(2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide has a molecular weight of 185.27 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-N-(4-methylcyclohexyl)propanamide is sourced from PubChem (CID 70253137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).