(1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol

C22H23NO — CID 67015665

IUPAC(1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol
SMILESCc1cc([C@H](O)CC(c2ccccc2)c2ccccc2C)ccn1
InChIInChI=1S/C22H23NO/c1-16-8-6-7-11-20(16)21(18-9-4-3-5-10-18)15-22(24)19-12-13-23-17(2)14-19/h3-14,21-22,24H,15H2,1-2H3/t21?,22-/m1/s1
InChIKeyWLMSATSXLQHJFJ-FOIFJWKZSA-N
MW317.43 g/mol
LogP4.95
Rot. Bonds5

About (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol

(1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol (PubChem CID 67015665) has the molecular formula C22H23NO and a molecular weight of 317.43 g/mol. Its IUPAC name is (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol.

Molecular Properties

Compound Name(1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol
PubChem CID67015665
Molecular FormulaC22H23NO
Molecular Weight317.43 g/mol
Exact Mass317.18
IUPAC Name(1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol
SMILESCc1cc([C@H](O)CC(c2ccccc2)c2ccccc2C)ccn1
InChIInChI=1S/C22H23NO/c1-16-8-6-7-11-20(16)21(18-9-4-3-5-10-18)15-22(24)19-12-13-23-17(2)14-19/h3-14,21-22,24H,15H2,1-2H3/t21?,22-/m1/s1
InChIKeyWLMSATSXLQHJFJ-FOIFJWKZSA-N
XLogP4.95
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-one
CID 67015695
4-[3-(4-bromophenyl)-3-(2-methylphenyl)-1-nitrosopropyl]-2-methylpyridine
CID 91898731
(S)-(2-methyl-4-pyridinyl)-phenylmethanol
CID 122230271
N-(2-hydroxyethyl)-2-[4-[(1R)-1-(2-methylphenyl)-3-(2-methyl-4-pyridinyl)-3-nitrosopropyl]phenyl]acetamide
CID 123850185
2-[5-[4-[1-(2-methylphenyl)-3-(2-methyl-4-pyridinyl)-3-nitrosopropyl]phenyl]-1,3,4-oxadiazol-2-yl]acetic acid
CID 123671528
2-(3-methylphenyl)-1-(2-methyl-4-pyridinyl)ethanol
CID 106756085
4-[[4-[(1R)-1-(2-methylphenyl)-3-(2-methyl-4-pyridinyl)-3-nitrosopropyl]benzoyl]amino]cyclohexane-1-carboxylic acid
CID 123710048
1-(2-methyl-4-pyridinyl)ethanol
CID 106756390
bis(2-methyl-4-propan-2-ylpyridine);2-propan-2-ylphenol
CID 161345551
5-(2-methyl-4-pyridinyl)-5-phenylpentanamide
CID 67314467
2-methyl-4-[(3R)-3-(2-methylphenyl)-3-(4-methylsulfonylphenyl)propyl]pyridine
CID 66666797
(3-methylphenyl)-(2-methyl-4-pyridinyl)methanol
CID 106756084

Frequently Asked Questions

What is the IUPAC name of (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol?
The IUPAC name of (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol (CID 67015665) is (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol.
What is the SMILES notation for (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol?
The canonical SMILES for (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol is Cc1cc([C@H](O)CC(c2ccccc2)c2ccccc2C)ccn1.
What is the InChIKey of (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol?
The InChIKey is WLMSATSXLQHJFJ-FOIFJWKZSA-N. The full InChI is InChI=1S/C22H23NO/c1-16-8-6-7-11-20(16)21(18-9-4-3-5-10-18)15-22(24)19-12-13-23-17(2)14-19/h3-14,21-22,24H,15H2,1-2H3/t21?,22-/m1/s1.
What are the key properties of (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol?
(1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol has a molecular weight of 317.43 g/mol, XLogP of 4.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-3-(2-methylphenyl)-1-(2-methyl-4-pyridinyl)-3-phenylpropan-1-ol is sourced from PubChem (CID 67015665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).