N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine

C24H24N2O — CID 175310014

IUPACN-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine
SMILESCOc1ccc(-c2ccc(C3=CCCCC3)cc2Nc2ccncc2)cc1
InChIInChI=1S/C24H24N2O/c1-27-22-10-7-19(8-11-22)23-12-9-20(18-5-3-2-4-6-18)17-24(23)26-21-13-15-25-16-14-21/h5,7-17H,2-4,6H2,1H3,(H,25,26)
InChIKeyUOPWOADZFBUHTJ-UHFFFAOYSA-N
MW356.47 g/mol
LogP6.46
Rot. Bonds5

About N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine

N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine (PubChem CID 175310014) has the molecular formula C24H24N2O and a molecular weight of 356.47 g/mol. Its IUPAC name is N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine.

Molecular Properties

Compound NameN-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine
PubChem CID175310014
Molecular FormulaC24H24N2O
Molecular Weight356.47 g/mol
Exact Mass356.19
IUPAC NameN-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine
SMILESCOc1ccc(-c2ccc(C3=CCCCC3)cc2Nc2ccncc2)cc1
InChIInChI=1S/C24H24N2O/c1-27-22-10-7-19(8-11-22)23-12-9-20(18-5-3-2-4-6-18)17-24(23)26-21-13-15-25-16-14-21/h5,7-17H,2-4,6H2,1H3,(H,25,26)
InChIKeyUOPWOADZFBUHTJ-UHFFFAOYSA-N
XLogP6.46
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.47
LogP ≤ 56.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclohexen-1-yl)-7-methoxy-6-(4-methoxyphenyl)-2-phenyl-N-pyridin-4-ylpyrazolo[1,5-a]pyrimidin-5-amine
CID 134307264
2-(cyclohexen-1-yl)-7-methoxyquinoline
CID 140669537
4-(cyclopenten-1-yl)-1,2-dimethoxybenzene
CID 71373642
4-[2-(4-methoxyphenyl)phenyl]pyridine
CID 173342516
1-(cyclopenten-1-yl)-3,5-dimethoxybenzene
CID 13172785
7-(cyclohexen-1-yl)-2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridine
CID 174194024
[4-(cyclohexen-1-yl)phenoxy]methylsilane
CID 160586501
4-(cyclopenten-1-yl)-1-fluoro-2-methoxybenzene
CID 57475769
N-(4-methoxy-2-nitrophenyl)pyridin-4-amine
CID 121011704
6-(cyclohexen-1-yl)-1,2,3,4-tetrahydronaphthalene
CID 20500285
2-[(1Z)-cyclododecen-1-yl]-6-methoxy-1-benzothiophene
CID 19002827
3-N-(4-methoxyphenyl)pyridine-3,4-diamine
CID 13441292

Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine?
The IUPAC name of N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine (CID 175310014) is N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine.
What is the SMILES notation for N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine?
The canonical SMILES for N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine is COc1ccc(-c2ccc(C3=CCCCC3)cc2Nc2ccncc2)cc1.
What is the InChIKey of N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine?
The InChIKey is UOPWOADZFBUHTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O/c1-27-22-10-7-19(8-11-22)23-12-9-20(18-5-3-2-4-6-18)17-24(23)26-21-13-15-25-16-14-21/h5,7-17H,2-4,6H2,1H3,(H,25,26).
What are the key properties of N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine?
N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine has a molecular weight of 356.47 g/mol, XLogP of 6.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclohexen-1-yl)-2-(4-methoxyphenyl)phenyl]pyridin-4-amine is sourced from PubChem (CID 175310014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).