1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one

C11H15NO2 — CID 106931100

IUPAC1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one
SMILESCc1cccn(COCC2CC2)c1=O
InChIInChI=1S/C11H15NO2/c1-9-3-2-6-12(11(9)13)8-14-7-10-4-5-10/h2-3,6,10H,4-5,7-8H2,1H3
InChIKeyKOHIHIPXDQLDPT-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.54
Rot. Bonds4

About 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one

1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one (PubChem CID 106931100) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one
PubChem CID106931100
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one
SMILESCc1cccn(COCC2CC2)c1=O
InChIInChI=1S/C11H15NO2/c1-9-3-2-6-12(11(9)13)8-14-7-10-4-5-10/h2-3,6,10H,4-5,7-8H2,1H3
InChIKeyKOHIHIPXDQLDPT-UHFFFAOYSA-N
XLogP1.54
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-1-(cyclopropylmethoxymethyl)pyridin-2-one
CID 106930418
1-(ethoxymethyl)-3-methylpyridin-2-one
CID 116621434
1-(2-cyclopropylethyl)-3-methylpyridin-2-one
CID 116621462
1-(methoxymethyl)-3-methylpyridin-2-one
CID 14787164
1-(cyclopentylmethyl)-3-methylpyridin-2-one
CID 115746868
1-[1-(cyclopropylmethoxymethyl)pyrrol-2-yl]-N-methylmethanamine
CID 106930149
1-(cyclopropylmethoxymethyl)-3-methylimidazol-2-one
CID 106931115
3-methyl-1-(oxan-4-ylmethyl)pyridin-2-one
CID 115634011
ethane;3-methyl-1-propylpyridin-2-one
CID 177013538
1-(2-fluoroethyl)-3-methylpyridin-2-one
CID 116621496
1-[2-cyclopropyl-2-(propylamino)ethyl]-3-methylpyridin-2-one
CID 63914629
5-amino-1-(cyclopropylmethoxymethyl)pyrimidine-2,4-dione
CID 106929489

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one?
The IUPAC name of 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one (CID 106931100) is 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one.
What is the SMILES notation for 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one?
The canonical SMILES for 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one is Cc1cccn(COCC2CC2)c1=O.
What is the InChIKey of 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one?
The InChIKey is KOHIHIPXDQLDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-9-3-2-6-12(11(9)13)8-14-7-10-4-5-10/h2-3,6,10H,4-5,7-8H2,1H3.
What are the key properties of 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one?
1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one has a molecular weight of 193.25 g/mol, XLogP of 1.54, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethoxymethyl)-3-methylpyridin-2-one is sourced from PubChem (CID 106931100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).