N-(1-hydroxybutan-2-yl)pentanamide

C9H19NO2 — CID 43417907

IUPACN-(1-hydroxybutan-2-yl)pentanamide
SMILESCCCCC(=O)NC(CC)CO
InChIInChI=1S/C9H19NO2/c1-3-5-6-9(12)10-8(4-2)7-11/h8,11H,3-7H2,1-2H3,(H,10,12)
InChIKeyIRMPJVCHSMHSLW-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.06
Rot. Bonds6

About N-(1-hydroxybutan-2-yl)pentanamide

N-(1-hydroxybutan-2-yl)pentanamide (PubChem CID 43417907) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N-(1-hydroxybutan-2-yl)pentanamide.

Molecular Properties

Compound NameN-(1-hydroxybutan-2-yl)pentanamide
PubChem CID43417907
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN-(1-hydroxybutan-2-yl)pentanamide
SMILESCCCCC(=O)NC(CC)CO
InChIInChI=1S/C9H19NO2/c1-3-5-6-9(12)10-8(4-2)7-11/h8,11H,3-7H2,1-2H3,(H,10,12)
InChIKeyIRMPJVCHSMHSLW-UHFFFAOYSA-N
XLogP1.06
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-1-hydroxybutan-2-yl]hexanamide
CID 104981701
4-hydroxy-N-(1-hydroxybutan-2-yl)butanamide
CID 79201131
N-(1,3-dihydroxypropan-2-yl)tridecanamide
CID 87498301
N-pentan-3-yldocosanamide
CID 123339332
N-[(2S)-1-hydroxybutan-2-yl]-4-methoxybutanamide
CID 104981240
4-ethoxy-N-(1-hydroxybutan-2-yl)butanamide
CID 112728067
N-[(2R)-1-hydroxybutan-2-yl]-3-methoxypropanamide
CID 103920011
1-butyl-3-(1-hydroxybutan-2-yl)urea
CID 43393019
N-[4-(1-hydroxybutan-2-ylamino)-4-oxobutyl]-2,2-dimethylpropanamide
CID 43417934
N-octan-4-ylpentanamide
CID 91803774
N-[(2S)-1-hydroxyoctadecan-2-yl]-31-oxotetratetracontanamide
CID 57043708
N-[(2S)-1-hydroxyoctadecan-2-yl]-31-oxohexatetracontanamide
CID 57005666

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxybutan-2-yl)pentanamide?
The IUPAC name of N-(1-hydroxybutan-2-yl)pentanamide (CID 43417907) is N-(1-hydroxybutan-2-yl)pentanamide.
What is the SMILES notation for N-(1-hydroxybutan-2-yl)pentanamide?
The canonical SMILES for N-(1-hydroxybutan-2-yl)pentanamide is CCCCC(=O)NC(CC)CO.
What is the InChIKey of N-(1-hydroxybutan-2-yl)pentanamide?
The InChIKey is IRMPJVCHSMHSLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-3-5-6-9(12)10-8(4-2)7-11/h8,11H,3-7H2,1-2H3,(H,10,12).
What are the key properties of N-(1-hydroxybutan-2-yl)pentanamide?
N-(1-hydroxybutan-2-yl)pentanamide has a molecular weight of 173.26 g/mol, XLogP of 1.06, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxybutan-2-yl)pentanamide is sourced from PubChem (CID 43417907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).