5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one

C11H18N2O — CID 55296910

IUPAC5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one
SMILESCCCCC(N)c1ccc(=O)[nH]c1C
InChIInChI=1S/C11H18N2O/c1-3-4-5-10(12)9-6-7-11(14)13-8(9)2/h6-7,10H,3-5,12H2,1-2H3,(H,13,14)
InChIKeyQRDOVFRWPMZMMM-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.87
Rot. Bonds4

About 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one

5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one (PubChem CID 55296910) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one
PubChem CID55296910
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one
SMILESCCCCC(N)c1ccc(=O)[nH]c1C
InChIInChI=1S/C11H18N2O/c1-3-4-5-10(12)9-6-7-11(14)13-8(9)2/h6-7,10H,3-5,12H2,1-2H3,(H,13,14)
InChIKeyQRDOVFRWPMZMMM-UHFFFAOYSA-N
XLogP1.87
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(1S)-1-amino-2-methylpropyl]-6-methyl-1H-pyridin-2-one
CID 130648700
5-[(1R,2S)-1-amino-2-hydroxypropyl]-6-methyl-1H-pyridin-2-one
CID 55294913
4-[(1R)-1-aminopentyl]-3-methylphenol
CID 55253511
(1S)-1-(4-methoxy-2-methylphenyl)pentan-1-amine;hydrochloride
CID 171233420
1-(2-propan-2-ylphenyl)pentan-1-amine
CID 171922235
(1R)-1-(2,3,4-trifluorophenyl)pentan-1-amine;hydrochloride
CID 171205782
1-(2,5-diethylphenyl)decan-1-amine
CID 65448585
(1S)-1-(2-ethyl-5-methylphenyl)butan-1-amine
CID 55296637
5-[(1S)-1-aminopropyl]-6-methyl-1H-pyridine-2-thione
CID 124502610
(1R)-1-(2-bromophenyl)pentan-1-amine
CID 171198050
(1R)-1-(2-bromo-4-fluorophenyl)pentan-1-amine;hydrochloride
CID 171201221
(1S)-1-(4-methylnaphthalen-1-yl)hexan-1-amine
CID 171228529

Frequently Asked Questions

What is the IUPAC name of 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one?
The IUPAC name of 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one (CID 55296910) is 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one.
What is the SMILES notation for 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one?
The canonical SMILES for 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one is CCCCC(N)c1ccc(=O)[nH]c1C.
What is the InChIKey of 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one?
The InChIKey is QRDOVFRWPMZMMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-4-5-10(12)9-6-7-11(14)13-8(9)2/h6-7,10H,3-5,12H2,1-2H3,(H,13,14).
What are the key properties of 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one?
5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one has a molecular weight of 194.28 g/mol, XLogP of 1.87, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-aminopentyl)-6-methyl-1H-pyridin-2-one is sourced from PubChem (CID 55296910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).