1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one

C10H13NO2 — CID 54703058

IUPAC1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one
SMILESCc1cc(O)cc(=O)n1CC1CC1
InChIInChI=1S/C10H13NO2/c1-7-4-9(12)5-10(13)11(7)6-8-2-3-8/h4-5,8,12H,2-3,6H2,1H3
InChIKeySALKCUXMQXPLRV-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.27
Rot. Bonds2

About 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one

1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one (PubChem CID 54703058) has the molecular formula C10H13NO2 and a molecular weight of 179.22 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one
PubChem CID54703058
Molecular FormulaC10H13NO2
Molecular Weight179.22 g/mol
Exact Mass179.09
IUPAC Name1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one
SMILESCc1cc(O)cc(=O)n1CC1CC1
InChIInChI=1S/C10H13NO2/c1-7-4-9(12)5-10(13)11(7)6-8-2-3-8/h4-5,8,12H,2-3,6H2,1H3
InChIKeySALKCUXMQXPLRV-UHFFFAOYSA-N
XLogP1.27
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-Hydroxy-1,6-dimethyl-1,2-dihydropyridin-2-one
CID 54676118
1-ethyl-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54680702
1-Cyclopropyl-4-hydroxy-6-methyl-1,2-dihydropyridin-2-one
CID 54704852
1-[1-(Fluoromethyl)cyclopropyl]-4-hydroxy-6-methylpyridin-2-one
CID 175934964
1-Butyl-4-hydroxy-6-(trifluoromethyl)pyridin-2-one
CID 172416749
4-Hydroxy-1-propyl-6-(trifluoromethyl)pyridin-2-one
CID 172416750
4-Hydroxy-1-(2-methylpropyl)-6-(trifluoromethyl)pyridin-2-one
CID 172416751
4-Hydroxy-6-methyl-1-propylpyridin-2(1H)-one
CID 54678658
1-allyl-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54687827
1-Butyl-4-hydroxy-6-methylpyridin-2-one
CID 54710228
3-bromo-1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2(1H)-one
CID 54724190
4-Hydroxy-6-methyl-1-(2-oxopropyl)pyridin-2-one
CID 59085682

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one?
The IUPAC name of 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one (CID 54703058) is 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one.
What is the SMILES notation for 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one?
The canonical SMILES for 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one is Cc1cc(O)cc(=O)n1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one?
The InChIKey is SALKCUXMQXPLRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO2/c1-7-4-9(12)5-10(13)11(7)6-8-2-3-8/h4-5,8,12H,2-3,6H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one?
1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one has a molecular weight of 179.22 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-4-hydroxy-6-methylpyridin-2-one is sourced from PubChem (CID 54703058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).