1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol

C17H21NO — CID 66459697

IUPAC1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol
SMILESCc1cccnc1CC(O)CCCc1ccccc1
InChIInChI=1S/C17H21NO/c1-14-7-6-12-18-17(14)13-16(19)11-5-10-15-8-3-2-4-9-15/h2-4,6-9,12,16,19H,5,10-11,13H2,1H3
InChIKeyFOEJORQYFMYDCY-UHFFFAOYSA-N
MW255.36 g/mol
LogP3.32
Rot. Bonds6

About 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol

1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol (PubChem CID 66459697) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol.

Molecular Properties

Compound Name1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol
PubChem CID66459697
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol
SMILESCc1cccnc1CC(O)CCCc1ccccc1
InChIInChI=1S/C17H21NO/c1-14-7-6-12-18-17(14)13-16(19)11-5-10-15-8-3-2-4-9-15/h2-4,6-9,12,16,19H,5,10-11,13H2,1H3
InChIKeyFOEJORQYFMYDCY-UHFFFAOYSA-N
XLogP3.32
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-4-phenylbutyl)-3-methylpyridine
CID 66453126
1-(4-methylphenyl)-5-phenylpentan-2-ol
CID 62606393
1-chloro-7-phenylheptan-4-ol
CID 54140253
3-methyl-2-[(2S)-2-(2-methylphenyl)propyl]pyridine
CID 165410451
(2R)-5-phenylpentane-1,2-diol
CID 102483629
1-(dimethylamino)-5-phenylpentan-2-ol
CID 79087865
2-[(3-fluorophenyl)methyl]-3-(3-methyl-2-pyridinyl)propanoic acid
CID 115982237
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4-phenylbutan-2-ol
CID 62608610
2-amino-3-(3-methyl-2-pyridinyl)propanoic acid
CID 3379209
1-(2-chloro-4-methylphenyl)-5-phenylpentan-2-ol
CID 106868054
1-(2-methoxyphenyl)-5-phenylpentan-2-ol
CID 62606153
2-[(4-chlorophenyl)methyl]-3-(3-methyl-2-pyridinyl)propanoic acid
CID 115982233

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol?
The IUPAC name of 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol (CID 66459697) is 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol.
What is the SMILES notation for 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol?
The canonical SMILES for 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol is Cc1cccnc1CC(O)CCCc1ccccc1.
What is the InChIKey of 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol?
The InChIKey is FOEJORQYFMYDCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO/c1-14-7-6-12-18-17(14)13-16(19)11-5-10-15-8-3-2-4-9-15/h2-4,6-9,12,16,19H,5,10-11,13H2,1H3.
What are the key properties of 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol?
1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol has a molecular weight of 255.36 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-pyridinyl)-5-phenylpentan-2-ol is sourced from PubChem (CID 66459697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).