N-(5-hydroxypentyl)-N-methylbutanamide

C10H21NO2 — CID 107201974

IUPACN-(5-hydroxypentyl)-N-methylbutanamide
SMILESCCCC(=O)N(C)CCCCCO
InChIInChI=1S/C10H21NO2/c1-3-7-10(13)11(2)8-5-4-6-9-12/h12H,3-9H2,1-2H3
InChIKeyDQVCEBNBPVMSOY-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.41
Rot. Bonds7

About N-(5-hydroxypentyl)-N-methylbutanamide

N-(5-hydroxypentyl)-N-methylbutanamide (PubChem CID 107201974) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-(5-hydroxypentyl)-N-methylbutanamide.

Molecular Properties

Compound NameN-(5-hydroxypentyl)-N-methylbutanamide
PubChem CID107201974
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-(5-hydroxypentyl)-N-methylbutanamide
SMILESCCCC(=O)N(C)CCCCCO
InChIInChI=1S/C10H21NO2/c1-3-7-10(13)11(2)8-5-4-6-9-12/h12H,3-9H2,1-2H3
InChIKeyDQVCEBNBPVMSOY-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
4-hydroxy-N-methyl-N-pentylbutanamide
CID 79203931
3-bromo-N-(5-hydroxypentyl)-N-methylpropanamide
CID 107198834
N-(3-hydroxypropyl)-N-methyldecanamide
CID 59366231
5-hydroxy-N-(3-hydroxypropyl)-N-methylpentanamide
CID 139993140
7-amino-N-(5-hydroxypentyl)-N-methylheptanamide
CID 107199281
5-bromo-N-(5-hydroxypentyl)-N-methylpentanamide
CID 107910777
N-methyl-N-octylheptacosanamide
CID 87394998
N-methyl-N-octylnonanamide
CID 140654825
N-(3-fluoropropyl)-N-methylbutanamide
CID 169103064
4-amino-N-(5-hydroxypentyl)-N,4-dimethylpentanamide
CID 107199292
3-acetamido-N-(5-hydroxypentyl)-N-methylpropanamide
CID 107202880

Frequently Asked Questions

What is the IUPAC name of N-(5-hydroxypentyl)-N-methylbutanamide?
The IUPAC name of N-(5-hydroxypentyl)-N-methylbutanamide (CID 107201974) is N-(5-hydroxypentyl)-N-methylbutanamide.
What is the SMILES notation for N-(5-hydroxypentyl)-N-methylbutanamide?
The canonical SMILES for N-(5-hydroxypentyl)-N-methylbutanamide is CCCC(=O)N(C)CCCCCO.
What is the InChIKey of N-(5-hydroxypentyl)-N-methylbutanamide?
The InChIKey is DQVCEBNBPVMSOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-3-7-10(13)11(2)8-5-4-6-9-12/h12H,3-9H2,1-2H3.
What are the key properties of N-(5-hydroxypentyl)-N-methylbutanamide?
N-(5-hydroxypentyl)-N-methylbutanamide 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 N-(5-hydroxypentyl)-N-methylbutanamide is sourced from PubChem (CID 107201974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).