(4-propylphenyl)-pyridin-3-ylmethanol

C15H17NO — CID 61087023

IUPAC(4-propylphenyl)-pyridin-3-ylmethanol
SMILESCCCc1ccc(C(O)c2cccnc2)cc1
InChIInChI=1S/C15H17NO/c1-2-4-12-6-8-13(9-7-12)15(17)14-5-3-10-16-11-14/h3,5-11,15,17H,2,4H2,1H3
InChIKeyCEDGDSFCZNJCCO-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.12
Rot. Bonds4

About (4-propylphenyl)-pyridin-3-ylmethanol

(4-propylphenyl)-pyridin-3-ylmethanol (PubChem CID 61087023) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is (4-propylphenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name(4-propylphenyl)-pyridin-3-ylmethanol
PubChem CID61087023
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name(4-propylphenyl)-pyridin-3-ylmethanol
SMILESCCCc1ccc(C(O)c2cccnc2)cc1
InChIInChI=1S/C15H17NO/c1-2-4-12-6-8-13(9-7-12)15(17)14-5-3-10-16-11-14/h3,5-11,15,17H,2,4H2,1H3
InChIKeyCEDGDSFCZNJCCO-UHFFFAOYSA-N
XLogP3.12
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[4-[hydroxy(pyridin-3-yl)methyl]phenyl]propanoic acid;hydrochloride
CID 70505959
[4-(diethoxymethyl)phenyl]-pyridin-3-ylmethanol
CID 10401799
(S)-[4-(dimethylamino)phenyl]-pyridin-3-ylmethanol
CID 129369618
[4-[[tert-butyl(dimethyl)silyl]oxymethyl]phenyl]-pyridin-3-ylmethanol
CID 23302982
(3-methoxyphenyl)-(4-propylphenyl)methanol
CID 61087387
(2,6-dimethyl-4-pyridinyl)-(4-propylphenyl)methanol
CID 107502916
(4-propylphenyl)-quinoxalin-6-ylmethanol
CID 62876417
1-(4-butylphenyl)-N-(1-pyridin-3-ylethyl)ethanamine
CID 43203644
(3-propoxyphenyl)-(4-propylphenyl)methanol
CID 62919013
(3-propan-2-yloxyphenyl)-(4-propylphenyl)methanol
CID 62919489
(4-methylsulfanylphenyl)-(4-propylphenyl)methanol
CID 79217067
(4-ethylphenyl)-(3-propylphenyl)methanol
CID 116542443

Frequently Asked Questions

What is the IUPAC name of (4-propylphenyl)-pyridin-3-ylmethanol?
The IUPAC name of (4-propylphenyl)-pyridin-3-ylmethanol (CID 61087023) is (4-propylphenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for (4-propylphenyl)-pyridin-3-ylmethanol?
The canonical SMILES for (4-propylphenyl)-pyridin-3-ylmethanol is CCCc1ccc(C(O)c2cccnc2)cc1.
What is the InChIKey of (4-propylphenyl)-pyridin-3-ylmethanol?
The InChIKey is CEDGDSFCZNJCCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-2-4-12-6-8-13(9-7-12)15(17)14-5-3-10-16-11-14/h3,5-11,15,17H,2,4H2,1H3.
What are the key properties of (4-propylphenyl)-pyridin-3-ylmethanol?
(4-propylphenyl)-pyridin-3-ylmethanol has a molecular weight of 227.31 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propylphenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 61087023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).