4-pyridin-3-ylpent-4-en-2-ol

C10H13NO — CID 130129461

IUPAC4-pyridin-3-ylpent-4-en-2-ol
SMILESC=C(CC(C)O)c1cccnc1
InChIInChI=1S/C10H13NO/c1-8(6-9(2)12)10-4-3-5-11-7-10/h3-5,7,9,12H,1,6H2,2H3
InChIKeyPKAGIAVNKFVKHR-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.87
Rot. Bonds3

About 4-pyridin-3-ylpent-4-en-2-ol

4-pyridin-3-ylpent-4-en-2-ol (PubChem CID 130129461) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is 4-pyridin-3-ylpent-4-en-2-ol.

Molecular Properties

Compound Name4-pyridin-3-ylpent-4-en-2-ol
PubChem CID130129461
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name4-pyridin-3-ylpent-4-en-2-ol
SMILESC=C(CC(C)O)c1cccnc1
InChIInChI=1S/C10H13NO/c1-8(6-9(2)12)10-4-3-5-11-7-10/h3-5,7,9,12H,1,6H2,2H3
InChIKeyPKAGIAVNKFVKHR-UHFFFAOYSA-N
XLogP1.87
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

propane-1,2-diol;pyridine-3-carboxylic acid
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N-[(2S)-2-hydroxypropyl]pyridine-3-carboxamide
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2-pyridin-3-ylpent-1-en-3-one
CID 155931297
4-methyl-4-pyridin-3-ylpentan-2-ol
CID 64716407
1-ethoxypropan-2-ol;pyridine-3-carboxylic acid
CID 158241647
methyl 2-hydroxy-4-oxo-4-pyridin-3-ylbutanoate
CID 21058132
1-(dimethylamino)ethanol;pyridine-3-carboxylic acid
CID 23620885
3-[(E)-5-methylhex-2-en-2-yl]pyridine
CID 18346839
1-pyridin-3-ylethanethione
CID 11815891
N-propan-2-ylpyridine-3-carbothioamide
CID 10241412
2-(methylamino)-1-pyridin-3-ylprop-2-en-1-one
CID 141355230
N,N-dimethyl-2-(1-pyridin-3-ylethenylsulfanyl)prop-2-en-1-amine
CID 143076346

Frequently Asked Questions

What is the IUPAC name of 4-pyridin-3-ylpent-4-en-2-ol?
The IUPAC name of 4-pyridin-3-ylpent-4-en-2-ol (CID 130129461) is 4-pyridin-3-ylpent-4-en-2-ol.
What is the SMILES notation for 4-pyridin-3-ylpent-4-en-2-ol?
The canonical SMILES for 4-pyridin-3-ylpent-4-en-2-ol is C=C(CC(C)O)c1cccnc1.
What is the InChIKey of 4-pyridin-3-ylpent-4-en-2-ol?
The InChIKey is PKAGIAVNKFVKHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-8(6-9(2)12)10-4-3-5-11-7-10/h3-5,7,9,12H,1,6H2,2H3.
What are the key properties of 4-pyridin-3-ylpent-4-en-2-ol?
4-pyridin-3-ylpent-4-en-2-ol has a molecular weight of 163.22 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-ylpent-4-en-2-ol is sourced from PubChem (CID 130129461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).