2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine

C14H17NO — CID 121385100

IUPAC2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine
SMILESCOC1C=C(CCc2ccccc2)C=CN1
InChIInChI=1S/C14H17NO/c1-16-14-11-13(9-10-15-14)8-7-12-5-3-2-4-6-12/h2-6,9-11,14-15H,7-8H2,1H3
InChIKeyLIIKTCZXECAPIU-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.63
Rot. Bonds4

About 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine

2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine (PubChem CID 121385100) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine.

Molecular Properties

Compound Name2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine
PubChem CID121385100
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine
SMILESCOC1C=C(CCc2ccccc2)C=CN1
InChIInChI=1S/C14H17NO/c1-16-14-11-13(9-10-15-14)8-7-12-5-3-2-4-6-12/h2-6,9-11,14-15H,7-8H2,1H3
InChIKeyLIIKTCZXECAPIU-UHFFFAOYSA-N
XLogP2.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(difluoromethyl)-2-[(E)-2-phenylethenyl]-3H-1,3-oxazole
CID 126707765
6-[(E)-2-[2-[5-(4-fluoro-2-methylphenyl)cyclohepta-2,3,5-trien-1-ylidene]ethenyl]pent-2-enoxy]-1,2-dihydropyridine
CID 145145124
2-benzylidene-5-(difluoromethoxy)-1H-pyridine
CID 174906781
4-Benzyl-5-(methoxymethyl)-1,2,3,6-tetrahydropyridine
CID 18791720
4-Benzyl-5-(methoxymethyl)-1,2,3,6-tetrahydropyridine;hydrochloride
CID 18791731
2-Phenylmethoxy-1,2-dihydropyridine
CID 18975042
1-[[(E)-2-phenylethenyl]amino]ethanol
CID 22114291
1-ethoxy-N-methyl-3-phenylprop-2-en-1-amine
CID 53679737
N-(1-ethoxy-3-phenylprop-2-enyl)butan-1-amine
CID 53819240
1-methoxy-N,N-dimethyl-3-phenylprop-2-en-1-amine
CID 53836202
N-(1-ethoxy-3-phenylprop-2-enyl)octan-1-amine
CID 53993824
1-Ethoxy-3-phenylprop-2-en-1-amine
CID 54067555

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine?
The IUPAC name of 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine (CID 121385100) is 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine.
What is the SMILES notation for 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine?
The canonical SMILES for 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine is COC1C=C(CCc2ccccc2)C=CN1.
What is the InChIKey of 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine?
The InChIKey is LIIKTCZXECAPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-16-14-11-13(9-10-15-14)8-7-12-5-3-2-4-6-12/h2-6,9-11,14-15H,7-8H2,1H3.
What are the key properties of 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine?
2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine has a molecular weight of 215.30 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-(2-phenylethyl)-1,2-dihydropyridine is sourced from PubChem (CID 121385100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).