3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine

C20H23NO — CID 141310429

IUPAC3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine
SMILESC=C(c1ccc(C(C)C)cc1)c1ccc(C2CC2)c(OC)n1
InChIInChI=1S/C20H23NO/c1-13(2)15-5-7-16(8-6-15)14(3)19-12-11-18(17-9-10-17)20(21-19)22-4/h5-8,11-13,17H,3,9-10H2,1-2,4H3
InChIKeyMSIFJWQQCXPCIN-UHFFFAOYSA-N
MW293.41 g/mol
LogP5.15
Rot. Bonds5

About 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine

3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine (PubChem CID 141310429) has the molecular formula C20H23NO and a molecular weight of 293.41 g/mol. Its IUPAC name is 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine.

Molecular Properties

Compound Name3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine
PubChem CID141310429
Molecular FormulaC20H23NO
Molecular Weight293.41 g/mol
Exact Mass293.18
IUPAC Name3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine
SMILESC=C(c1ccc(C(C)C)cc1)c1ccc(C2CC2)c(OC)n1
InChIInChI=1S/C20H23NO/c1-13(2)15-5-7-16(8-6-15)14(3)19-12-11-18(17-9-10-17)20(21-19)22-4/h5-8,11-13,17H,3,9-10H2,1-2,4H3
InChIKeyMSIFJWQQCXPCIN-UHFFFAOYSA-N
XLogP5.15
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.41
LogP ≤ 55.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3-chloro-4-propan-2-ylphenyl)-(5-cyclopropyl-6-methoxy-2-pyridinyl)methanone
CID 58452587
(5-cyclopropyl-6-methoxy-2-pyridinyl)-(4-cyclopropylsulfanyl-3-methylphenyl)methanone
CID 58452885
(5-cyclopropyl-6-methoxy-2-pyridinyl)methanol
CID 67396693
(5R)-5-[2-(5-cyclopropyl-6-methoxy-2-pyridinyl)-2-(4-methylsulfanylphenyl)ethenyl]pyrrolidin-2-one
CID 67400669
(5R)-5-[2-(4-tert-butylphenyl)-2-(5-cyclopropyl-6-methoxy-2-pyridinyl)ethenyl]pyrrolidin-2-one
CID 67396302
[3-[tert-butyl(dimethyl)silyl]oxyphenyl]-(5-cyclopropyl-6-methoxy-2-pyridinyl)methanone
CID 67396211
(5R)-5-[(E)-2-[3-chloro-4-(trifluoromethyl)phenyl]-2-(5-cyclopropyl-6-methoxy-2-pyridinyl)ethenyl]pyrrolidin-2-one
CID 67398778
3-chloro-6-[1-[3-chloro-4-(4-methylpentoxy)phenyl]ethenyl]-2-methoxypyridine
CID 89016523
methyl (2S)-2-[[5-cyclopropyl-6-(cyclopropylmethoxy)pyridine-2-carbonyl]amino]-4-methylpentanoate
CID 71087876
tert-butyl (2R)-2-[2-(4-tert-butylphenyl)-2-(5-cyclopropyl-6-methoxy-2-pyridinyl)ethenyl]-5-oxopyrrolidine-1-carboxylate
CID 123656564
[5-(4-propan-2-ylbenzoyl)oxy-4-tricyclo[6.2.1.02,7]undeca-2,4,6-trienyl] 4-propan-2-ylbenzoate
CID 174180175
(2-cyclopropylphenyl)-(4-propan-2-ylphenyl)methanol
CID 79983378

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine?
The IUPAC name of 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine (CID 141310429) is 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine.
What is the SMILES notation for 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine?
The canonical SMILES for 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine is C=C(c1ccc(C(C)C)cc1)c1ccc(C2CC2)c(OC)n1.
What is the InChIKey of 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine?
The InChIKey is MSIFJWQQCXPCIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO/c1-13(2)15-5-7-16(8-6-15)14(3)19-12-11-18(17-9-10-17)20(21-19)22-4/h5-8,11-13,17H,3,9-10H2,1-2,4H3.
What are the key properties of 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine?
3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine has a molecular weight of 293.41 g/mol, XLogP of 5.15, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-2-methoxy-6-[1-(4-propan-2-ylphenyl)ethenyl]pyridine is sourced from PubChem (CID 141310429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).