4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide

C11H21NO3 — CID 106137727

IUPAC4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide
SMILESO=C(CCCO)NCC1CCC(O)CC1
InChIInChI=1S/C11H21NO3/c13-7-1-2-11(15)12-8-9-3-5-10(14)6-4-9/h9-10,13-14H,1-8H2,(H,12,15)
InChIKeyJDHOLYNQGCPRSD-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.43
Rot. Bonds5

About 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide

4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide (PubChem CID 106137727) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide.

Molecular Properties

Compound Name4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide
PubChem CID106137727
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide
SMILESO=C(CCCO)NCC1CCC(O)CC1
InChIInChI=1S/C11H21NO3/c13-7-1-2-11(15)12-8-9-3-5-10(14)6-4-9/h9-10,13-14H,1-8H2,(H,12,15)
InChIKeyJDHOLYNQGCPRSD-UHFFFAOYSA-N
XLogP0.43
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-[(4-hydroxycyclohexyl)methyl]hexanamide
CID 106135658
N-[(4-hydroxycyclohexyl)methyl]-3-sulfanylpropanamide
CID 106137800
5-hydroxy-N-[(4-methylcyclohexyl)methyl]pentanamide
CID 79208918
5-hydroxy-N-[(3-hydroxycyclohexyl)methyl]pentanamide
CID 106137719
N-[(4-hydroxycyclohexyl)methyl]-2-sulfanylacetamide
CID 106137809
4-hydroxy-N-(thiolan-3-ylmethyl)butanamide
CID 107298400
N-[(4-hydroxycyclohexyl)methyl]prop-2-enamide
CID 106124120
N-(2-cyclopropylethyl)-4-hydroxybutanamide
CID 79192412
3-(tert-butylamino)-N-[(4-hydroxycyclohexyl)methyl]propanamide
CID 106135794
5-chloro-N-[(3-hydroxycyclopentyl)methyl]pentanamide
CID 106127901
N-[(4-hydroxycyclohexyl)methyl]-3-methylbut-2-enamide
CID 106123870
6-amino-N-(cyclopropylmethyl)hexanamide
CID 24707919

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide?
The IUPAC name of 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide (CID 106137727) is 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide.
What is the SMILES notation for 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide?
The canonical SMILES for 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide is O=C(CCCO)NCC1CCC(O)CC1.
What is the InChIKey of 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide?
The InChIKey is JDHOLYNQGCPRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c13-7-1-2-11(15)12-8-9-3-5-10(14)6-4-9/h9-10,13-14H,1-8H2,(H,12,15).
What are the key properties of 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide?
4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide has a molecular weight of 215.29 g/mol, XLogP of 0.43, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(4-hydroxycyclohexyl)methyl]butanamide is sourced from PubChem (CID 106137727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).