5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine

C24H23FN2O — CID 142350989

IUPAC5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine
SMILESCOc1cc(/C=C(\F)c2ccc(Nc3ccccc3C)nc2)cc(C2CC2)c1
InChIInChI=1S/C24H23FN2O/c1-16-5-3-4-6-23(16)27-24-10-9-19(15-26-24)22(25)13-17-11-20(18-7-8-18)14-21(12-17)28-2/h3-6,9-15,18H,7-8H2,1-2H3,(H,26,27)/b22-13-
InChIKeyHBYQXBBOEFYRAI-XKZIYDEJSA-N
MW374.46 g/mol
LogP6.49
Rot. Bonds6

About 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine

5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine (PubChem CID 142350989) has the molecular formula C24H23FN2O and a molecular weight of 374.46 g/mol. Its IUPAC name is 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine.

Molecular Properties

Compound Name5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine
PubChem CID142350989
Molecular FormulaC24H23FN2O
Molecular Weight374.46 g/mol
Exact Mass374.18
IUPAC Name5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine
SMILESCOc1cc(/C=C(\F)c2ccc(Nc3ccccc3C)nc2)cc(C2CC2)c1
InChIInChI=1S/C24H23FN2O/c1-16-5-3-4-6-23(16)27-24-10-9-19(15-26-24)22(25)13-17-11-20(18-7-8-18)14-21(12-17)28-2/h3-6,9-15,18H,7-8H2,1-2H3,(H,26,27)/b22-13-
InChIKeyHBYQXBBOEFYRAI-XKZIYDEJSA-N
XLogP6.49
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500374.46
LogP ≤ 56.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(Z)-2-(2,6-dichloro-3-ethoxy-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine
CID 155441905
6-(2-methylanilino)pyridine-3-carbonyl chloride
CID 151910424
6-(4-methoxy-2-methylanilino)pyridine-3-carboxylic acid
CID 55130145
3,4-dimethoxy-N-[6-(2-methylanilino)-3-pyridinyl]benzamide
CID 113016106
N-(2,4-dimethoxyphenyl)-6-(2,3-dimethylanilino)pyridine-3-carboxamide
CID 109162768
3-methoxy-N-[6-(2-methylanilino)pyridazin-3-yl]benzamide
CID 113045604
N-[6-(2-methylanilino)-3-pyridinyl]cyclopropanecarboxamide
CID 113016079
N-cyclohexyl-6-(2-methoxyanilino)pyridine-3-carboxamide
CID 648229
6-(4-chloro-2-methoxy-5-methylanilino)-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 109163247
2,5-dimethoxy-N-[6-(2-methylanilino)-3-pyridinyl]benzenesulfonamide
CID 113016171
cyclopropane;ethane;5-[(Z)-2-(3-ethyl-5-methoxyphenyl)-1-fluoroethenyl]-2-methylpyridine;prop-1-yne;1,2,3-trimethylcyclohexa-1,3-diene
CID 142350994
N-[6-(2,3-dimethylanilino)-3-pyridinyl]-4-methoxybenzamide
CID 113017268

Frequently Asked Questions

What is the IUPAC name of 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine?
The IUPAC name of 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine (CID 142350989) is 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine.
What is the SMILES notation for 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine?
The canonical SMILES for 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine is COc1cc(/C=C(\F)c2ccc(Nc3ccccc3C)nc2)cc(C2CC2)c1.
What is the InChIKey of 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine?
The InChIKey is HBYQXBBOEFYRAI-XKZIYDEJSA-N. The full InChI is InChI=1S/C24H23FN2O/c1-16-5-3-4-6-23(16)27-24-10-9-19(15-26-24)22(25)13-17-11-20(18-7-8-18)14-21(12-17)28-2/h3-6,9-15,18H,7-8H2,1-2H3,(H,26,27)/b22-13-.
What are the key properties of 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine?
5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine has a molecular weight of 374.46 g/mol, XLogP of 6.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(Z)-2-(3-cyclopropyl-5-methoxyphenyl)-1-fluoroethenyl]-N-(2-methylphenyl)pyridin-2-amine is sourced from PubChem (CID 142350989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).