1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol

C8H11NO — CID 145471802

IUPAC1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol
SMILESC=C(O)C1=CNCC=C1C
InChIInChI=1S/C8H11NO/c1-6-3-4-9-5-8(6)7(2)10/h3,5,9-10H,2,4H2,1H3
InChIKeyCCTGMGDRFJJRFX-UHFFFAOYSA-N
MW137.18 g/mol
LogP1.49
Rot. Bonds1

About 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol

1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol (PubChem CID 145471802) has the molecular formula C8H11NO and a molecular weight of 137.18 g/mol. Its IUPAC name is 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol.

Molecular Properties

Compound Name1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol
PubChem CID145471802
Molecular FormulaC8H11NO
Molecular Weight137.18 g/mol
Exact Mass137.08
IUPAC Name1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol
SMILESC=C(O)C1=CNCC=C1C
InChIInChI=1S/C8H11NO/c1-6-3-4-9-5-8(6)7(2)10/h3,5,9-10H,2,4H2,1H3
InChIKeyCCTGMGDRFJJRFX-UHFFFAOYSA-N
XLogP1.49
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.18
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2H-2-benzazepin-6-ol
CID 18004599
2,3-Dihydroisoquinolin-5-ol
CID 91247829
3-(3-Methyl-1,2-dihydropyridin-5-yl)cyclohexa-1,3-dien-1-ol
CID 118548938
1-(1,2-Dihydropyridin-5-yl)propan-2-ol
CID 129171628
5-Ethyl-6-methyl-1,2-dihydropyridin-4-ol
CID 141401214
3-(Methylaminomethyl)cyclohexa-1,3-dien-1-ol
CID 143349340
4-Methyl-2-(methylamino)-6-methylidenecyclohexa-1,3-dien-1-ol
CID 164094262
(Z)-1-[[(2Z,4Z)-4-ethylhepta-2,4-dienyl]amino]-3-methylpent-1-en-3-ol
CID 170279098
2H-cyclohepta[c]pyridin-4-ol
CID 171853945
2-(1,2-Dihydropyridin-5-yl)propan-2-ol
CID 173120691
1-Amino-1-(1,2-dihydropyridin-4-yl)prop-2-en-1-ol
CID 174294309
6-Ethyl-2,3-dihydroisoquinolin-8-ol
CID 174963305

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol?
The IUPAC name of 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol (CID 145471802) is 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol.
What is the SMILES notation for 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol?
The canonical SMILES for 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol is C=C(O)C1=CNCC=C1C.
What is the InChIKey of 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol?
The InChIKey is CCTGMGDRFJJRFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO/c1-6-3-4-9-5-8(6)7(2)10/h3,5,9-10H,2,4H2,1H3.
What are the key properties of 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol?
1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol has a molecular weight of 137.18 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-1,2-dihydropyridin-5-yl)ethenol is sourced from PubChem (CID 145471802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).