4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine

C18H17NO — CID 172710264

IUPAC4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine
SMILESC1=NCCC(c2ccc(OCc3ccccc3)cc2)=C1
InChIInChI=1S/C18H17NO/c1-2-4-15(5-3-1)14-20-18-8-6-16(7-9-18)17-10-12-19-13-11-17/h1-10,12H,11,13-14H2
InChIKeyFDQLKYJIVLGSIZ-UHFFFAOYSA-N
MW263.34 g/mol
LogP4.12
Rot. Bonds4

About 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine

4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine (PubChem CID 172710264) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine.

Molecular Properties

Compound Name4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine
PubChem CID172710264
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine
SMILESC1=NCCC(c2ccc(OCc3ccccc3)cc2)=C1
InChIInChI=1S/C18H17NO/c1-2-4-15(5-3-1)14-20-18-8-6-16(7-9-18)17-10-12-19-13-11-17/h1-10,12H,11,13-14H2
InChIKeyFDQLKYJIVLGSIZ-UHFFFAOYSA-N
XLogP4.12
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenylmethoxy-4-[9-(4-phenylmethoxyphenoxy)nonoxy]benzene
CID 43835980
3-(4-phenylmethoxyphenyl)-4,5-dihydro-1H-pyridazin-6-one
CID 141093047
1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
fluoromethane;1-methyl-4-phenylmethoxybenzene
CID 91304163
4-(4-phenylmethoxyphenyl)-2,5-dihydro-1H-imidazole
CID 57130327
2-benzyl-5-(4-phenylmethoxyphenyl)pyrimidine
CID 174577128
(4-phenylmethoxyphenyl) hypobromite
CID 151898979
4-phenylmethoxyaniline
CID 159966727
methyl-tris(4-phenylmethoxyphenyl)silane
CID 90283739
4-(chloromethyl)-2-(4-phenylmethoxyphenyl)-1,3-thiazole
CID 43322647
[1-methyl-4-(4-phenylmethoxyphenyl)cyclohex-3-en-1-yl]methanol
CID 18436343
3-cyclopentyl-2-(4-phenylmethoxyphenyl)cyclopent-2-en-1-one
CID 66879244

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine?
The IUPAC name of 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine (CID 172710264) is 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine.
What is the SMILES notation for 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine?
The canonical SMILES for 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine is C1=NCCC(c2ccc(OCc3ccccc3)cc2)=C1.
What is the InChIKey of 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine?
The InChIKey is FDQLKYJIVLGSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c1-2-4-15(5-3-1)14-20-18-8-6-16(7-9-18)17-10-12-19-13-11-17/h1-10,12H,11,13-14H2.
What are the key properties of 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine?
4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine has a molecular weight of 263.34 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenylmethoxyphenyl)-2,3-dihydropyridine is sourced from PubChem (CID 172710264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).