5-methyl-1-pyridin-2-ylhexan-1-ol

C12H19NO — CID 83158842

IUPAC5-methyl-1-pyridin-2-ylhexan-1-ol
SMILESCC(C)CCCC(O)c1ccccn1
InChIInChI=1S/C12H19NO/c1-10(2)6-5-8-12(14)11-7-3-4-9-13-11/h3-4,7,9-10,12,14H,5-6,8H2,1-2H3
InChIKeyFJGUFLRTNZVZHF-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.94
Rot. Bonds5

About 5-methyl-1-pyridin-2-ylhexan-1-ol

5-methyl-1-pyridin-2-ylhexan-1-ol (PubChem CID 83158842) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 5-methyl-1-pyridin-2-ylhexan-1-ol.

Molecular Properties

Compound Name5-methyl-1-pyridin-2-ylhexan-1-ol
PubChem CID83158842
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name5-methyl-1-pyridin-2-ylhexan-1-ol
SMILESCC(C)CCCC(O)c1ccccn1
InChIInChI=1S/C12H19NO/c1-10(2)6-5-8-12(14)11-7-3-4-9-13-11/h3-4,7,9-10,12,14H,5-6,8H2,1-2H3
InChIKeyFJGUFLRTNZVZHF-UHFFFAOYSA-N
XLogP2.94
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-amino-1-pyridin-2-ylbutan-1-ol
CID 151032283
N-ethyl-5-methyl-1-pyridin-2-ylhexan-1-amine
CID 83161018
2-chloro-1-pyridin-2-ylethanol
CID 22145518
3-amino-3-methyl-1-pyridin-2-ylbutan-1-ol
CID 82408899
4-hydroxy-4-pyridin-2-ylbutanal
CID 54060730
CID 172780589
CID 172780589
(1S)-1-pyridin-2-ylethanol;hydrochloride
CID 71757448
4-hydroxy-4-pyridin-2-ylbutane-2-sulfonamide
CID 140565025
5-methyl-1-phenylhexan-1-ol
CID 10997859
(1S)-2-methyl-1-pyridin-2-ylpropan-1-ol
CID 51670363
(1S,2S)-1-pyridin-2-ylpropane-1,2-diol
CID 28766943
1,2-dipyridin-2-ylethanol
CID 11458306

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-pyridin-2-ylhexan-1-ol?
The IUPAC name of 5-methyl-1-pyridin-2-ylhexan-1-ol (CID 83158842) is 5-methyl-1-pyridin-2-ylhexan-1-ol.
What is the SMILES notation for 5-methyl-1-pyridin-2-ylhexan-1-ol?
The canonical SMILES for 5-methyl-1-pyridin-2-ylhexan-1-ol is CC(C)CCCC(O)c1ccccn1.
What is the InChIKey of 5-methyl-1-pyridin-2-ylhexan-1-ol?
The InChIKey is FJGUFLRTNZVZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-10(2)6-5-8-12(14)11-7-3-4-9-13-11/h3-4,7,9-10,12,14H,5-6,8H2,1-2H3.
What are the key properties of 5-methyl-1-pyridin-2-ylhexan-1-ol?
5-methyl-1-pyridin-2-ylhexan-1-ol has a molecular weight of 193.29 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-pyridin-2-ylhexan-1-ol is sourced from PubChem (CID 83158842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).