6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol

C9H15NO — CID 157164893

IUPAC6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol
SMILESC=C1NCC(C(C)C)C=C1O
InChIInChI=1S/C9H15NO/c1-6(2)8-4-9(11)7(3)10-5-8/h4,6,8,10-11H,3,5H2,1-2H3
InChIKeyZYKQZIDGNUAEOA-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.82
Rot. Bonds1

About 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol

6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol (PubChem CID 157164893) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol.

Molecular Properties

Compound Name6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol
PubChem CID157164893
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol
SMILESC=C1NCC(C(C)C)C=C1O
InChIInChI=1S/C9H15NO/c1-6(2)8-4-9(11)7(3)10-5-8/h4,6,8,10-11H,3,5H2,1-2H3
InChIKeyZYKQZIDGNUAEOA-UHFFFAOYSA-N
XLogP1.82
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;(3E,5E)-5-(propylamino)octa-3,5-dien-4-ol
CID 143711001
4-hydroxy-5-[[(2S)-2-methylbutyl]amino]cyclohexa-3,5-diene-1,2-dione
CID 153965711
6-Amino-3-(ethylamino)cyclohexa-1,5-dien-1-ol
CID 163903234
6-Methyl-3-propan-2-yl-1,2-dihydropyridin-4-ol
CID 165106739
(3E)-2-(propylamino)hexa-1,3-dien-3-ol
CID 166783149
5-(Ethylamino)cyclohexa-1,5-dien-1-ol
CID 173028013
(3E,5E)-5-(propylamino)octa-3,5-dien-4-ol
CID 143711002
4-methyl-6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol
CID 157164896
6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-4-ol
CID 159199386

Frequently Asked Questions

What is the IUPAC name of 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol?
The IUPAC name of 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol (CID 157164893) is 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol.
What is the SMILES notation for 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol?
The canonical SMILES for 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol is C=C1NCC(C(C)C)C=C1O.
What is the InChIKey of 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol?
The InChIKey is ZYKQZIDGNUAEOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-6(2)8-4-9(11)7(3)10-5-8/h4,6,8,10-11H,3,5H2,1-2H3.
What are the key properties of 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol?
6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol has a molecular weight of 153.22 g/mol, XLogP of 1.82, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylidene-3-propan-2-yl-2,3-dihydro-1H-pyridin-5-ol is sourced from PubChem (CID 157164893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).