cyclobutyl-(3-methoxy-4-pyridinyl)methanone

C11H13NO2 — CID 105065110

IUPACcyclobutyl-(3-methoxy-4-pyridinyl)methanone
SMILESCOc1cnccc1C(=O)C1CCC1
InChIInChI=1S/C11H13NO2/c1-14-10-7-12-6-5-9(10)11(13)8-3-2-4-8/h5-8H,2-4H2,1H3
InChIKeyAOYMQPYPNSZJNE-UHFFFAOYSA-N
MW191.23 g/mol
LogP2.07
Rot. Bonds3

About cyclobutyl-(3-methoxy-4-pyridinyl)methanone

cyclobutyl-(3-methoxy-4-pyridinyl)methanone (PubChem CID 105065110) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is cyclobutyl-(3-methoxy-4-pyridinyl)methanone.

Molecular Properties

Compound Namecyclobutyl-(3-methoxy-4-pyridinyl)methanone
PubChem CID105065110
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Namecyclobutyl-(3-methoxy-4-pyridinyl)methanone
SMILESCOc1cnccc1C(=O)C1CCC1
InChIInChI=1S/C11H13NO2/c1-14-10-7-12-6-5-9(10)11(13)8-3-2-4-8/h5-8H,2-4H2,1H3
InChIKeyAOYMQPYPNSZJNE-UHFFFAOYSA-N
XLogP2.07
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 52.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

cyclobutyl-(3-fluoro-4-pyridinyl)methanone
CID 119030457
(4-methoxy-3-pyridinyl)-(9-thiabicyclo[3.3.1]nonan-3-yl)methanone
CID 171943461
(4-methoxy-3-pyridinyl)-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)methanone
CID 171943456
N-(2-bromocyclopentyl)-3-methoxypyridine-4-carboxamide
CID 105063711
cyclooctyl-(2-methoxyphenyl)methanone
CID 80602820
N-[(1R,2R)-2-hydroxycyclohexyl]-3-methoxypyridine-4-carboxamide
CID 102739207
N-(2-chloroethyl)-N-cyclopropyl-3-methoxypyridine-4-carboxamide
CID 105064483
3-methoxy-N-[4-(methylamino)cyclohexyl]pyridine-4-carboxamide
CID 105063330
3-[(3-methoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 105063233
[3-(aminomethyl)piperidin-1-yl]-(3-methoxy-4-pyridinyl)methanone
CID 105062936
2-[[(3-methoxypyridine-4-carbonyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 105063230
cyclobutyl-(2-fluoro-3-methoxyphenyl)methanone
CID 82807656

Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(3-methoxy-4-pyridinyl)methanone?
The IUPAC name of cyclobutyl-(3-methoxy-4-pyridinyl)methanone (CID 105065110) is cyclobutyl-(3-methoxy-4-pyridinyl)methanone.
What is the SMILES notation for cyclobutyl-(3-methoxy-4-pyridinyl)methanone?
The canonical SMILES for cyclobutyl-(3-methoxy-4-pyridinyl)methanone is COc1cnccc1C(=O)C1CCC1.
What is the InChIKey of cyclobutyl-(3-methoxy-4-pyridinyl)methanone?
The InChIKey is AOYMQPYPNSZJNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO2/c1-14-10-7-12-6-5-9(10)11(13)8-3-2-4-8/h5-8H,2-4H2,1H3.
What are the key properties of cyclobutyl-(3-methoxy-4-pyridinyl)methanone?
cyclobutyl-(3-methoxy-4-pyridinyl)methanone has a molecular weight of 191.23 g/mol, XLogP of 2.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(3-methoxy-4-pyridinyl)methanone is sourced from PubChem (CID 105065110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).