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

C11H23NO3 — CID 107159465

IUPAC4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide
SMILESCC(C)CC(O)CNC(=O)CCC(C)O
InChIInChI=1S/C11H23NO3/c1-8(2)6-10(14)7-12-11(15)5-4-9(3)13/h8-10,13-14H,4-7H2,1-3H3,(H,12,15)
InChIKeyMHJGYFDFHLYUMV-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.67
Rot. Bonds7

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

4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide (PubChem CID 107159465) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide
PubChem CID107159465
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide
SMILESCC(C)CC(O)CNC(=O)CCC(C)O
InChIInChI=1S/C11H23NO3/c1-8(2)6-10(14)7-12-11(15)5-4-9(3)13/h8-10,13-14H,4-7H2,1-3H3,(H,12,15)
InChIKeyMHJGYFDFHLYUMV-UHFFFAOYSA-N
XLogP0.67
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 ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(2-hydroxy-4-methylpentyl)amino]-6-oxohexanoic acid
CID 107151219
N-[3-[(2-hydroxy-4-methylpentyl)amino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 103771590
N-(2-hydroxy-4-methylpentyl)-4-pyrrol-1-ylbutanamide
CID 109409829
N-[(2S)-2-hydroxypropyl]-4-methylpentanamide
CID 83030953
4-hydroxy-N-(2-methylbutyl)pentanamide
CID 79193367
N-(2-hydroxy-4-methylpentyl)-2-propan-2-ylsulfanylacetamide
CID 103771239
4-hydroxy-N-(3-methylbutyl)pentanamide
CID 79001671
3-[(2-hydroxy-4-methylpentyl)amino]-2-methyl-3-oxopropanoic acid
CID 107155574
N-(2-hydroxy-4-methylpentyl)-3-(2,2,2-trifluoroethoxy)propanamide
CID 103770915
4-hydroxy-N-(4-methylpentan-2-yl)pentanamide
CID 79204272
N-[3-[(2-hydroxy-4-methylpentyl)amino]-3-oxopropyl]cyclopentanecarboxamide
CID 103771616
3-(aminomethyl)-N-(2-hydroxy-4-methylpentyl)-5-methylhexanamide
CID 107152937

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide?
The IUPAC name of 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide (CID 107159465) is 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide is CC(C)CC(O)CNC(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide?
The InChIKey is MHJGYFDFHLYUMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO3/c1-8(2)6-10(14)7-12-11(15)5-4-9(3)13/h8-10,13-14H,4-7H2,1-3H3,(H,12,15).
What are the key properties of 4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide?
4-hydroxy-N-(2-hydroxy-4-methylpentyl)pentanamide has a molecular weight of 217.31 g/mol, XLogP of 0.67, 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-4-methylpentyl)pentanamide is sourced from PubChem (CID 107159465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).