1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one

C10H13NO3 — CID 129259580

IUPAC1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one
SMILESCOc1ccc(COCC(C)=O)cn1
InChIInChI=1S/C10H13NO3/c1-8(12)6-14-7-9-3-4-10(13-2)11-5-9/h3-5H,6-7H2,1-2H3
InChIKeyPKISBMMAVQRXRV-UHFFFAOYSA-N
MW195.22 g/mol
LogP1.20
Rot. Bonds5

About 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one

1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one (PubChem CID 129259580) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one.

Molecular Properties

Compound Name1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one
PubChem CID129259580
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one
SMILESCOc1ccc(COCC(C)=O)cn1
InChIInChI=1S/C10H13NO3/c1-8(12)6-14-7-9-3-4-10(13-2)11-5-9/h3-5H,6-7H2,1-2H3
InChIKeyPKISBMMAVQRXRV-UHFFFAOYSA-N
XLogP1.20
TPSA48.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(6-methoxy-3-pyridinyl)propan-2-one
CID 19760371
2-[(6-methoxy-3-pyridinyl)methoxy]-N-(2-pyridin-2-ylpyrimidin-4-yl)acetamide
CID 129255796
(6-methoxy-3-pyridinyl)methyl 1,2-oxazole-3-carboxylate
CID 71869279
ethyl 2-(6-methoxy-3-pyridinyl)acetate
CID 131699443
2-[(6-methoxy-3-pyridinyl)methoxy]-N-[(4-methyl-6,7-dihydrothieno[3,2-c]pyran-4-yl)methyl]acetamide
CID 167816970
[3-methoxy-4-[(6-methoxy-3-pyridinyl)methoxy]phenyl]methylcarbamic acid
CID 118389322
1-(6,8-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-2-[(6-methoxy-3-pyridinyl)methoxy]ethanone
CID 126826772
1-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-2-[(6-methoxy-3-pyridinyl)methoxy]ethanone
CID 126822306
methyl 2-[(6-methoxy-3-pyridinyl)methylsulfanyl]acetate
CID 123951100
1-N,4-N-bis[(6-methoxy-3-pyridinyl)methyl]benzene-1,4-dicarboxamide
CID 24646071
2-[(6-methoxy-3-pyridinyl)methoxy]-1-(4-thieno[3,2-c]pyridin-4-ylpiperazin-1-yl)ethanone
CID 126822666
4-ethyl-1-(6-methoxy-3-pyridinyl)hexan-2-one
CID 82920700

Frequently Asked Questions

What is the IUPAC name of 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one?
The IUPAC name of 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one (CID 129259580) is 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one.
What is the SMILES notation for 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one?
The canonical SMILES for 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one is COc1ccc(COCC(C)=O)cn1.
What is the InChIKey of 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one?
The InChIKey is PKISBMMAVQRXRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3/c1-8(12)6-14-7-9-3-4-10(13-2)11-5-9/h3-5H,6-7H2,1-2H3.
What are the key properties of 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one?
1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one has a molecular weight of 195.22 g/mol, XLogP of 1.20, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(6-methoxy-3-pyridinyl)methoxy]propan-2-one is sourced from PubChem (CID 129259580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).