3-amino-1-(5-hydroxypentyl)pyridin-2-one

C10H16N2O2 — CID 62228665

IUPAC3-amino-1-(5-hydroxypentyl)pyridin-2-one
SMILESNc1cccn(CCCCCO)c1=O
InChIInChI=1S/C10H16N2O2/c11-9-5-4-7-12(10(9)14)6-2-1-3-8-13/h4-5,7,13H,1-3,6,8,11H2
InChIKeyMJKNRJQUIMWVQP-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.59
Rot. Bonds5

About 3-amino-1-(5-hydroxypentyl)pyridin-2-one

3-amino-1-(5-hydroxypentyl)pyridin-2-one (PubChem CID 62228665) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3-amino-1-(5-hydroxypentyl)pyridin-2-one.

Molecular Properties

Compound Name3-amino-1-(5-hydroxypentyl)pyridin-2-one
PubChem CID62228665
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3-amino-1-(5-hydroxypentyl)pyridin-2-one
SMILESNc1cccn(CCCCCO)c1=O
InChIInChI=1S/C10H16N2O2/c11-9-5-4-7-12(10(9)14)6-2-1-3-8-13/h4-5,7,13H,1-3,6,8,11H2
InChIKeyMJKNRJQUIMWVQP-UHFFFAOYSA-N
XLogP0.59
TPSA68.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-Amino-1-(3-hydroxypropyl)-1,2-dihydropyridin-2-one
CID 62100478
3-Amino-1-(4-hydroxycyclohexyl)-2(1H)-pyridinone
CID 118139919
1-[(1R,2S)-2-hydroxycyclopentyl]-3-(methylamino)pyridin-2-one
CID 137449088
3-Amino-1-(9-hydroxynonan-4-yl)pyridin-2-one
CID 137449786
3-amino-1-[(3S)-3-hydroxycyclohexyl]pyridin-2-one
CID 137450417
3-amino-1-[(1S,3S)-3-hydroxycyclohexyl]pyridin-2-one
CID 137450777
3-amino-1-[(3R)-3-hydroxycyclohexyl]pyridin-2-one
CID 137450813
3-amino-1-[(1R,2S)-2-hydroxycyclopentyl]pyridin-2-one
CID 137450914
3-amino-1-[(1R,3R)-3-hydroxycyclohexyl]pyridin-2-one
CID 137450915
3-amino-1-[(1S,2R)-2-hydroxycyclopentyl]pyridin-2-one
CID 137457484
3-amino-1-[(2R)-oxan-2-yl]pyridin-2-one
CID 139373517
3-amino-1-[(2S)-oxan-2-yl]pyridin-2-one
CID 139373542

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(5-hydroxypentyl)pyridin-2-one?
The IUPAC name of 3-amino-1-(5-hydroxypentyl)pyridin-2-one (CID 62228665) is 3-amino-1-(5-hydroxypentyl)pyridin-2-one.
What is the SMILES notation for 3-amino-1-(5-hydroxypentyl)pyridin-2-one?
The canonical SMILES for 3-amino-1-(5-hydroxypentyl)pyridin-2-one is Nc1cccn(CCCCCO)c1=O.
What is the InChIKey of 3-amino-1-(5-hydroxypentyl)pyridin-2-one?
The InChIKey is MJKNRJQUIMWVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c11-9-5-4-7-12(10(9)14)6-2-1-3-8-13/h4-5,7,13H,1-3,6,8,11H2.
What are the key properties of 3-amino-1-(5-hydroxypentyl)pyridin-2-one?
3-amino-1-(5-hydroxypentyl)pyridin-2-one has a molecular weight of 196.25 g/mol, XLogP of 0.59, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(5-hydroxypentyl)pyridin-2-one is sourced from PubChem (CID 62228665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).