2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine

C20H22N2 — CID 123156978

IUPAC2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine
SMILESCCC(c1ccncc1)C1C=CC(c2ccccc2)=NC1C
InChIInChI=1S/C20H22N2/c1-3-18(16-11-13-21-14-12-16)19-9-10-20(22-15(19)2)17-7-5-4-6-8-17/h4-15,18-19H,3H2,1-2H3
InChIKeySMINHVWUSIYCOH-UHFFFAOYSA-N
MW290.41 g/mol
LogP4.64
Rot. Bonds4

About 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine

2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine (PubChem CID 123156978) has the molecular formula C20H22N2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine.

Molecular Properties

Compound Name2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine
PubChem CID123156978
Molecular FormulaC20H22N2
Molecular Weight290.41 g/mol
Exact Mass290.18
IUPAC Name2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine
SMILESCCC(c1ccncc1)C1C=CC(c2ccccc2)=NC1C
InChIInChI=1S/C20H22N2/c1-3-18(16-11-13-21-14-12-16)19-9-10-20(22-15(19)2)17-7-5-4-6-8-17/h4-15,18-19H,3H2,1-2H3
InChIKeySMINHVWUSIYCOH-UHFFFAOYSA-N
XLogP4.64
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-pyridin-4-ylpropan-1-amine
CID 26722519
trimethyl-(2-phenyl-2-pyridin-4-ylethyl)silane
CID 132534673
4-benzhydrylpyridine;ethane
CID 90843990
zinc tetrakis(4-pentan-3-ylpyridine)
CID 50909730
4-(1,2-diphenyl-2-pyridin-4-ylethyl)pyridine
CID 12691374
azane;4-phenylpyridine
CID 175775455
4-(2,6-diphenyloctan-4-yl)pyridine;methane
CID 157478380
1-N-methyl-1-N-(2-phenylethyl)-1-pyridin-4-ylbutane-1,2-diamine
CID 65482923
N-methyl-N-(1-phenylpropyl)pyridin-4-amine
CID 23457999
2-(1-phenylpropyl)-1,3-dioxolane
CID 14365156
4-(2-methyl-2,3-dihydropyridin-6-yl)pyridine
CID 144876252
4-[bromo(phenyl)methyl]pyridine
CID 43608201

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine?
The IUPAC name of 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine (CID 123156978) is 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine.
What is the SMILES notation for 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine?
The canonical SMILES for 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine is CCC(c1ccncc1)C1C=CC(c2ccccc2)=NC1C.
What is the InChIKey of 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine?
The InChIKey is SMINHVWUSIYCOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2/c1-3-18(16-11-13-21-14-12-16)19-9-10-20(22-15(19)2)17-7-5-4-6-8-17/h4-15,18-19H,3H2,1-2H3.
What are the key properties of 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine?
2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine has a molecular weight of 290.41 g/mol, XLogP of 4.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-phenyl-3-(1-pyridin-4-ylpropyl)-2,3-dihydropyridine is sourced from PubChem (CID 123156978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).