(2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene

C24H25NO2 — CID 70532937

IUPAC(2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene
SMILESC=CCOCC=C.OC(c1cccnc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C18H15NO.C6H10O/c20-18(15-9-6-12-19-13-15)17-11-5-4-10-16(17)14-7-2-1-3-8-14;1-3-5-7-6-4-2/h1-13,18,20H;3-4H,1-2,5-6H2
InChIKeyBRZMZGGVZXSZEN-UHFFFAOYSA-N
MW359.47 g/mol
LogP5.21
Rot. Bonds7

About (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene

(2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene (PubChem CID 70532937) has the molecular formula C24H25NO2 and a molecular weight of 359.47 g/mol. Its IUPAC name is (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene.

Molecular Properties

Compound Name(2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene
PubChem CID70532937
Molecular FormulaC24H25NO2
Molecular Weight359.47 g/mol
Exact Mass359.19
IUPAC Name(2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene
SMILESC=CCOCC=C.OC(c1cccnc1)c1ccccc1-c1ccccc1
InChIInChI=1S/C18H15NO.C6H10O/c20-18(15-9-6-12-19-13-15)17-11-5-4-10-16(17)14-7-2-1-3-8-14;1-3-5-7-6-4-2/h1-13,18,20H;3-4H,1-2,5-6H2
InChIKeyBRZMZGGVZXSZEN-UHFFFAOYSA-N
XLogP5.21
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500359.47
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

naphthalen-1-yl(pyridin-3-yl)methanol;3-prop-2-enoxyprop-1-ene
CID 70482779
(2,4-diphenylthiophen-3-yl)-pyridin-3-ylmethanol
CID 24745262
1-tert-butyl-4-[(4-tert-butylphenyl)methoxymethyl]benzene;(4-phenylphenyl)-pyridin-3-ylmethanol
CID 70482599
2-[hydroxy(pyridin-3-yl)methyl]benzonitrile
CID 69484555
disodium;1,1'-biphenyl;hydride;3-prop-2-enoxyprop-1-ene
CID 173405020
[3-(hydroxymethyl)-4-pyridinyl]-phenylmethanol
CID 59205218
(R)-(2-fluoro-3-pyridinyl)-pyridin-3-ylmethanol
CID 86334771
(2-cyclopropylphenyl)-pyridin-3-ylmethanol
CID 79982582
2,2-dipyridin-3-ylethanol
CID 57450821
phenyl-[2-(3-prop-2-enoxyprop-1-ynyl)phenyl]methanol
CID 165350820
(2S)-2-amino-2-(2-pyridin-3-ylphenyl)acetic acid
CID 66512915
pyridin-3-yl(pyrimidin-2-yl)methanol
CID 54244340

Frequently Asked Questions

What is the IUPAC name of (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene?
The IUPAC name of (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene (CID 70532937) is (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene.
What is the SMILES notation for (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene?
The canonical SMILES for (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene is C=CCOCC=C.OC(c1cccnc1)c1ccccc1-c1ccccc1.
What is the InChIKey of (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene?
The InChIKey is BRZMZGGVZXSZEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO.C6H10O/c20-18(15-9-6-12-19-13-15)17-11-5-4-10-16(17)14-7-2-1-3-8-14;1-3-5-7-6-4-2/h1-13,18,20H;3-4H,1-2,5-6H2.
What are the key properties of (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene?
(2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene has a molecular weight of 359.47 g/mol, XLogP of 5.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-phenylphenyl)-pyridin-3-ylmethanol;3-prop-2-enoxyprop-1-ene is sourced from PubChem (CID 70532937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).