4-hydroxy-N-(3-methylbutyl)pentanamide

C10H21NO2 — CID 79001671

IUPAC4-hydroxy-N-(3-methylbutyl)pentanamide
SMILESCC(C)CCNC(=O)CCC(C)O
InChIInChI=1S/C10H21NO2/c1-8(2)6-7-11-10(13)5-4-9(3)12/h8-9,12H,4-7H2,1-3H3,(H,11,13)
InChIKeyZJAFHUNDFJZBDX-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.31
Rot. Bonds6

About 4-hydroxy-N-(3-methylbutyl)pentanamide

4-hydroxy-N-(3-methylbutyl)pentanamide (PubChem CID 79001671) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 4-hydroxy-N-(3-methylbutyl)pentanamide.

Molecular Properties

Compound Name4-hydroxy-N-(3-methylbutyl)pentanamide
PubChem CID79001671
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name4-hydroxy-N-(3-methylbutyl)pentanamide
SMILESCC(C)CCNC(=O)CCC(C)O
InChIInChI=1S/C10H21NO2/c1-8(2)6-7-11-10(13)5-4-9(3)12/h8-9,12H,4-7H2,1-3H3,(H,11,13)
InChIKeyZJAFHUNDFJZBDX-UHFFFAOYSA-N
XLogP1.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N,N'-bis(3-methylbutyl)hexanediamide
CID 5045138
3-amino-N-[(3S)-3-hydroxybutyl]propanamide
CID 86323935
4,4-dimethyl-N-(3-methylbutyl)pentanamide
CID 135139773
4-hydroxy-N-(3-hydroxy-4-methoxybutyl)pentanamide
CID 106248553
N'-[(3R,5S)-3,5-dihydroxy-7-methyloctyl]-N-(3-methylbutyl)butanediamide
CID 177167256
5-hydroxy-N-[4-(5-hydroxyhexanoylamino)butyl]hexanamide
CID 101050420
N-(4-aminobutyl)-4-hydroxypentanamide
CID 79203295
N-[3-(dimethylamino)-3-oxopropyl]-4-hydroxypentanamide
CID 79204974
4-hydroxy-N-(2-methylsulfonylethyl)pentanamide
CID 79192328
N-[(2S)-2-hydroxypropyl]-4-methylpentanamide
CID 83030953
N-(3-methylbutyl)-3-[2-[3-[2-(sulfanylamino)ethoxy]propanoylamino]ethoxy]propanamide
CID 170123968
ethane;N-(3-methylbutyl)octadecanamide
CID 172601405

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(3-methylbutyl)pentanamide?
The IUPAC name of 4-hydroxy-N-(3-methylbutyl)pentanamide (CID 79001671) is 4-hydroxy-N-(3-methylbutyl)pentanamide.
What is the SMILES notation for 4-hydroxy-N-(3-methylbutyl)pentanamide?
The canonical SMILES for 4-hydroxy-N-(3-methylbutyl)pentanamide is CC(C)CCNC(=O)CCC(C)O.
What is the InChIKey of 4-hydroxy-N-(3-methylbutyl)pentanamide?
The InChIKey is ZJAFHUNDFJZBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-8(2)6-7-11-10(13)5-4-9(3)12/h8-9,12H,4-7H2,1-3H3,(H,11,13).
What are the key properties of 4-hydroxy-N-(3-methylbutyl)pentanamide?
4-hydroxy-N-(3-methylbutyl)pentanamide has a molecular weight of 187.28 g/mol, XLogP of 1.31, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(3-methylbutyl)pentanamide is sourced from PubChem (CID 79001671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).