4-hydroxy-N-methyl-N-pentylbutanamide

C10H21NO2 — CID 79203931

IUPAC4-hydroxy-N-methyl-N-pentylbutanamide
SMILESCCCCCN(C)C(=O)CCCO
InChIInChI=1S/C10H21NO2/c1-3-4-5-8-11(2)10(13)7-6-9-12/h12H,3-9H2,1-2H3
InChIKeyQYEYYIZTFJWUHL-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.41
Rot. Bonds7

About 4-hydroxy-N-methyl-N-pentylbutanamide

4-hydroxy-N-methyl-N-pentylbutanamide (PubChem CID 79203931) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 4-hydroxy-N-methyl-N-pentylbutanamide.

Molecular Properties

Compound Name4-hydroxy-N-methyl-N-pentylbutanamide
PubChem CID79203931
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name4-hydroxy-N-methyl-N-pentylbutanamide
SMILESCCCCCN(C)C(=O)CCCO
InChIInChI=1S/C10H21NO2/c1-3-4-5-8-11(2)10(13)7-6-9-12/h12H,3-9H2,1-2H3
InChIKeyQYEYYIZTFJWUHL-UHFFFAOYSA-N
XLogP1.41
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(5-hydroxypentyl)-N-methyldodecanamide
CID 107201995
N-(3-hydroxypropyl)-N-methyldecanamide
CID 59366231
N-methyl-N-octylheptacosanamide
CID 87394998
N-methyl-N-octylnonanamide
CID 140654825
N-(5-hydroxypentyl)-N-methylbutanamide
CID 107201974
N-[3-(dimethylamino)propyl]-4-hydroxy-N-methylbutanamide
CID 79191572
5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
CID 139993140
10-[methyl(pentyl)amino]-10-oxodecanoic acid
CID 143390074
N-(3-aminopropyl)-N-methylheptanamide
CID 115737512
N-(3-aminopropyl)-N-methyldecanamide
CID 65447774
N-(3-aminopropyl)-N-methyloctanamide
CID 43125160
4-[heptanoyl(methyl)amino]butanoic acid
CID 43172442

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-methyl-N-pentylbutanamide?
The IUPAC name of 4-hydroxy-N-methyl-N-pentylbutanamide (CID 79203931) is 4-hydroxy-N-methyl-N-pentylbutanamide.
What is the SMILES notation for 4-hydroxy-N-methyl-N-pentylbutanamide?
The canonical SMILES for 4-hydroxy-N-methyl-N-pentylbutanamide is CCCCCN(C)C(=O)CCCO.
What is the InChIKey of 4-hydroxy-N-methyl-N-pentylbutanamide?
The InChIKey is QYEYYIZTFJWUHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-4-5-8-11(2)10(13)7-6-9-12/h12H,3-9H2,1-2H3.
What are the key properties of 4-hydroxy-N-methyl-N-pentylbutanamide?
4-hydroxy-N-methyl-N-pentylbutanamide has a molecular weight of 187.28 g/mol, XLogP of 1.41, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-methyl-N-pentylbutanamide is sourced from PubChem (CID 79203931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).