(2-methoxyphenyl)-pyridin-3-ylmethanone

C13H11NO2 — CID 18357321

IUPAC(2-methoxyphenyl)-pyridin-3-ylmethanone
SMILESCOc1ccccc1C(=O)c1cccnc1
InChIInChI=1S/C13H11NO2/c1-16-12-7-3-2-6-11(12)13(15)10-5-4-8-14-9-10/h2-9H,1H3
InChIKeySDNHBUNRMRBNOE-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.32
Rot. Bonds3

About (2-methoxyphenyl)-pyridin-3-ylmethanone

(2-methoxyphenyl)-pyridin-3-ylmethanone (PubChem CID 18357321) has the molecular formula C13H11NO2 and a molecular weight of 213.24 g/mol. Its IUPAC name is (2-methoxyphenyl)-pyridin-3-ylmethanone.

Molecular Properties

Compound Name(2-methoxyphenyl)-pyridin-3-ylmethanone
PubChem CID18357321
Molecular FormulaC13H11NO2
Molecular Weight213.24 g/mol
Exact Mass213.08
IUPAC Name(2-methoxyphenyl)-pyridin-3-ylmethanone
SMILESCOc1ccccc1C(=O)c1cccnc1
InChIInChI=1S/C13H11NO2/c1-16-12-7-3-2-6-11(12)13(15)10-5-4-8-14-9-10/h2-9H,1H3
InChIKeySDNHBUNRMRBNOE-UHFFFAOYSA-N
XLogP2.32
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-[1-(2-methoxyphenyl)ethenyl]pyridine
CID 146574086
[[amino(pyridin-3-yl)methylidene]amino] 2-methoxybenzoate
CID 4206330
(2-methoxycarbonylphenyl) pyridine-3-carboxylate;hydrochloride
CID 171109487
methyl 4-(2-methoxybenzoyl)benzoate
CID 22408243
[2-(2-methoxyphenoxy)phenyl]-phenylmethanone
CID 157433245
(3,4-dimethylphenyl)-(2-methoxyphenyl)methanone
CID 24722768
[2-chloro-3-(difluoromethoxy)phenyl]-pyridin-3-ylmethanone
CID 134621435
(2-ethoxy-5-methylphenyl)-pyridin-3-ylmethanone
CID 115000096
(111C)methyl pyridine-3-carboxylate
CID 11309537
[2-(difluoromethyl)-5-methoxyphenyl]-pyridin-3-ylmethanone
CID 134621203
(2-methoxyphenyl)-quinolin-8-ylmethanone
CID 81215631
2-methoxy-4-(2-methoxybenzoyl)benzaldehyde
CID 10825897

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)-pyridin-3-ylmethanone?
The IUPAC name of (2-methoxyphenyl)-pyridin-3-ylmethanone (CID 18357321) is (2-methoxyphenyl)-pyridin-3-ylmethanone.
What is the SMILES notation for (2-methoxyphenyl)-pyridin-3-ylmethanone?
The canonical SMILES for (2-methoxyphenyl)-pyridin-3-ylmethanone is COc1ccccc1C(=O)c1cccnc1.
What is the InChIKey of (2-methoxyphenyl)-pyridin-3-ylmethanone?
The InChIKey is SDNHBUNRMRBNOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO2/c1-16-12-7-3-2-6-11(12)13(15)10-5-4-8-14-9-10/h2-9H,1H3.
What are the key properties of (2-methoxyphenyl)-pyridin-3-ylmethanone?
(2-methoxyphenyl)-pyridin-3-ylmethanone has a molecular weight of 213.24 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)-pyridin-3-ylmethanone is sourced from PubChem (CID 18357321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).