(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone

C20H24N2O2 — CID 46517992

IUPAC(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)n1ccc(C)c/c1=N\C1CCCCC1
InChIInChI=1S/C20H24N2O2/c1-15-12-13-22(19(14-15)21-16-8-4-3-5-9-16)20(23)17-10-6-7-11-18(17)24-2/h6-7,10-14,16H,3-5,8-9H2,1-2H3/b21-19+
InChIKeySKQYSEVZRNPDRV-XUTLUUPISA-N
MW324.42 g/mol
LogP3.73
Rot. Bonds3

About (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone

(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone (PubChem CID 46517992) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone.

Molecular Properties

Compound Name(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone
PubChem CID46517992
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone
SMILESCOc1ccccc1C(=O)n1ccc(C)c/c1=N\C1CCCCC1
InChIInChI=1S/C20H24N2O2/c1-15-12-13-22(19(14-15)21-16-8-4-3-5-9-16)20(23)17-10-6-7-11-18(17)24-2/h6-7,10-14,16H,3-5,8-9H2,1-2H3/b21-19+
InChIKeySKQYSEVZRNPDRV-XUTLUUPISA-N
XLogP3.73
TPSA43.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(2-cyclohexylimino-4-methyl-1-pyridinyl)-[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]methanone
CID 42945715
(2-cyclohexylimino-1-pyridinyl)-(2,4-difluorophenyl)methanone
CID 16626252
(2-cyclohexylimino-4-methyl-1-pyridinyl)-(1-methylsulfonylpiperidin-4-yl)methanone
CID 42935769
(3aR,7aS)-2-[2-(2-cyclohexylimino-4-methyl-1-pyridinyl)-2-oxoethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 98316850
[4-(2-methoxy-5-methylbenzoyl)piperazin-1-yl]-(2-methoxyphenyl)methanone
CID 110814937
cyclooctyl-(2-methoxyphenyl)methanone
CID 80602820
(2-methoxyphenyl)-[(2R)-2-(3-methylphenyl)pyrrolidin-1-yl]methanone
CID 95053415
indol-1-yl-(2-methoxyphenyl)methanone
CID 39846486
(4-cyclopentylpiperazin-1-yl)-(2-methoxyphenyl)methanone
CID 796432
(3-cyclohexylsulfonylazetidin-1-yl)-(2-methoxyphenyl)methanone
CID 71809296
[(3R)-3-hydroxypyrrolidin-1-yl]-(2-methoxyphenyl)methanone
CID 10560934
1-cyclohexyl-3-[1-(2-methoxybenzoyl)piperidin-4-yl]urea
CID 127232346

Frequently Asked Questions

What is the IUPAC name of (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone?
The IUPAC name of (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone (CID 46517992) is (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone.
What is the SMILES notation for (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone?
The canonical SMILES for (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone is COc1ccccc1C(=O)n1ccc(C)c/c1=N\C1CCCCC1.
What is the InChIKey of (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone?
The InChIKey is SKQYSEVZRNPDRV-XUTLUUPISA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15-12-13-22(19(14-15)21-16-8-4-3-5-9-16)20(23)17-10-6-7-11-18(17)24-2/h6-7,10-14,16H,3-5,8-9H2,1-2H3/b21-19+.
What are the key properties of (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone?
(2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone has a molecular weight of 324.42 g/mol, XLogP of 3.73, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclohexylimino-4-methyl-1-pyridinyl)-(2-methoxyphenyl)methanone is sourced from PubChem (CID 46517992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).