2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol

C10H11NO — CID 11084179

IUPAC2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol
SMILESC=C=C(C)C(O)c1ccccn1
InChIInChI=1S/C10H11NO/c1-3-8(2)10(12)9-6-4-5-7-11-9/h4-7,10,12H,1H2,2H3
InChIKeyYJPRVNZSOIXHKB-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.85
Rot. Bonds2

About 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol

2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol (PubChem CID 11084179) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol.

Molecular Properties

Compound Name2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol
PubChem CID11084179
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol
SMILESC=C=C(C)C(O)c1ccccn1
InChIInChI=1S/C10H11NO/c1-3-8(2)10(12)9-6-4-5-7-11-9/h4-7,10,12H,1H2,2H3
InChIKeyYJPRVNZSOIXHKB-UHFFFAOYSA-N
XLogP1.85
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[hydroxy(pyridin-2-yl)methyl]prop-2-enenitrile
CID 11446496
(1S)-1-pyridin-2-ylethanol;hydrochloride
CID 71757448
(1R)-1-hydroxy-3,3-dimethyl-1-pyridin-2-ylbutan-2-one
CID 166005900
dipyridin-2-ylmethanol;palladium(2+);dichloride
CID 173385206
(1S,2S)-1-pyridin-2-ylpropane-1,2-diol
CID 28766943
(1S)-2-methyl-1-pyridin-2-ylpropan-1-ol
CID 51670363
N-[(1R)-1-pyridin-2-ylethyl]hydroxylamine
CID 51441798
(3S,4R)-4-hydroxy-3-methyl-4-pyridin-2-ylbutan-2-one
CID 130697576
2-(dipyridin-2-ylmethyl)pyridine
CID 10332212
ethyl 2-[hydroxy(pyridin-2-yl)methyl]prop-2-enoate
CID 15812390
1-pyridin-2-ylpent-3-yn-1-ol
CID 62309977
2,2,2-trichloro-1-pyridin-2-ylethanol
CID 3066911

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol?
The IUPAC name of 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol (CID 11084179) is 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol.
What is the SMILES notation for 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol?
The canonical SMILES for 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol is C=C=C(C)C(O)c1ccccn1.
What is the InChIKey of 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol?
The InChIKey is YJPRVNZSOIXHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-3-8(2)10(12)9-6-4-5-7-11-9/h4-7,10,12H,1H2,2H3.
What are the key properties of 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol?
2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol has a molecular weight of 161.20 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-pyridin-2-ylbuta-2,3-dien-1-ol is sourced from PubChem (CID 11084179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).