4-cyclohexyl-N-(2-hydroxyethyl)butanamide

C12H23NO2 — CID 43389022

IUPAC4-cyclohexyl-N-(2-hydroxyethyl)butanamide
SMILESO=C(CCCC1CCCCC1)NCCO
InChIInChI=1S/C12H23NO2/c14-10-9-13-12(15)8-4-7-11-5-2-1-3-6-11/h11,14H,1-10H2,(H,13,15)
InChIKeyHMROJXMYVBSJEL-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.85
Rot. Bonds6

About 4-cyclohexyl-N-(2-hydroxyethyl)butanamide

4-cyclohexyl-N-(2-hydroxyethyl)butanamide (PubChem CID 43389022) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-cyclohexyl-N-(2-hydroxyethyl)butanamide.

Molecular Properties

Compound Name4-cyclohexyl-N-(2-hydroxyethyl)butanamide
PubChem CID43389022
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name4-cyclohexyl-N-(2-hydroxyethyl)butanamide
SMILESO=C(CCCC1CCCCC1)NCCO
InChIInChI=1S/C12H23NO2/c14-10-9-13-12(15)8-4-7-11-5-2-1-3-6-11/h11,14H,1-10H2,(H,13,15)
InChIKeyHMROJXMYVBSJEL-UHFFFAOYSA-N
XLogP1.85
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-N-(2-hydroxyethyl)butanamide?
The IUPAC name of 4-cyclohexyl-N-(2-hydroxyethyl)butanamide (CID 43389022) is 4-cyclohexyl-N-(2-hydroxyethyl)butanamide.
What is the SMILES notation for 4-cyclohexyl-N-(2-hydroxyethyl)butanamide?
The canonical SMILES for 4-cyclohexyl-N-(2-hydroxyethyl)butanamide is O=C(CCCC1CCCCC1)NCCO.
What is the InChIKey of 4-cyclohexyl-N-(2-hydroxyethyl)butanamide?
The InChIKey is HMROJXMYVBSJEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c14-10-9-13-12(15)8-4-7-11-5-2-1-3-6-11/h11,14H,1-10H2,(H,13,15).
What are the key properties of 4-cyclohexyl-N-(2-hydroxyethyl)butanamide?
4-cyclohexyl-N-(2-hydroxyethyl)butanamide has a molecular weight of 213.32 g/mol, XLogP of 1.85, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-N-(2-hydroxyethyl)butanamide is sourced from PubChem (CID 43389022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).