4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide

C11H23NO3 — CID 106295714

IUPAC4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide
SMILESCCCC(C)(O)CNC(=O)CCC(C)O
InChIInChI=1S/C11H23NO3/c1-4-7-11(3,15)8-12-10(14)6-5-9(2)13/h9,13,15H,4-8H2,1-3H3,(H,12,14)
InChIKeyZHRGAOMQKHBGBU-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.81
Rot. Bonds7

About 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide

4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide (PubChem CID 106295714) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide
PubChem CID106295714
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide
SMILESCCCC(C)(O)CNC(=O)CCC(C)O
InChIInChI=1S/C11H23NO3/c1-4-7-11(3,15)8-12-10(14)6-5-9(2)13/h9,13,15H,4-8H2,1-3H3,(H,12,14)
InChIKeyZHRGAOMQKHBGBU-UHFFFAOYSA-N
XLogP0.81
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-(2-hydroxy-2-methylpropyl)pentanamide
CID 79192407
3-acetamido-N-(2-hydroxy-2-methylpentyl)propanamide
CID 103713019
3-[(2-hydroxy-2-methylpentyl)amino]-2-methyl-3-oxopropanoic acid
CID 106295623
3-amino-N-(2-hydroxy-2-methylpentyl)-4-methylpentanamide
CID 106292069
4,4,4-trifluoro-N-(2-hydroxy-2,5-dimethylhexyl)butanamide
CID 111485192
3-(cyclopropylamino)-N-(2-hydroxy-2-methylpentyl)propanamide
CID 106292266
N-(2-hydroxy-4-methoxy-2-methylbutyl)butanamide
CID 103712321
N-(2-hydroxy-2,4-dimethylpentyl)pentanamide
CID 66178352
N-(2-hydroxy-2-methylpentyl)-2-methyl-3-(methylamino)propanamide
CID 106292285
N-(2-hydroxy-2-methylpentyl)-2-propoxyacetamide
CID 103713311
N-(2,4-diethyl-2,4-dimethylheptyl)-4-methylpentanamide
CID 155322176
4-hydroxy-N-(2,2,3,3-tetrafluoropropyl)pentanamide
CID 106295708

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide?
The IUPAC name of 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide (CID 106295714) is 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide is CCCC(C)(O)CNC(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide?
The InChIKey is ZHRGAOMQKHBGBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-4-7-11(3,15)8-12-10(14)6-5-9(2)13/h9,13,15H,4-8H2,1-3H3,(H,12,14).
What are the key properties of 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide?
4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide has a molecular weight of 217.31 g/mol, XLogP of 0.81, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(2-hydroxy-2-methylpentyl)pentanamide is sourced from PubChem (CID 106295714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).