1H-pyridin-2-ylidenemethanol

C6H7NO — CID 154723052

IUPAC1H-pyridin-2-ylidenemethanol
SMILESOC=C1C=CC=CN1
InChIInChI=1S/C6H7NO/c8-5-6-3-1-2-4-7-6/h1-5,7-8H
InChIKeyLEJLNWUGHZBJCB-UHFFFAOYSA-N
MW109.13 g/mol
LogP1.06
Rot. Bonds

About 1H-pyridin-2-ylidenemethanol

1H-pyridin-2-ylidenemethanol (PubChem CID 154723052) has the molecular formula C6H7NO and a molecular weight of 109.13 g/mol. Its IUPAC name is 1H-pyridin-2-ylidenemethanol.

Molecular Properties

Compound Name1H-pyridin-2-ylidenemethanol
PubChem CID154723052
Molecular FormulaC6H7NO
Molecular Weight109.13 g/mol
Exact Mass109.05
IUPAC Name1H-pyridin-2-ylidenemethanol
SMILESOC=C1C=CC=CN1
InChIInChI=1S/C6H7NO/c8-5-6-3-1-2-4-7-6/h1-5,7-8H
InChIKeyLEJLNWUGHZBJCB-UHFFFAOYSA-N
XLogP1.06
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 51.06
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

(2Z)-2-(1H-pyridin-2-ylidene)acetic acid
CID 101366543
2-[2-(trifluoromethyl)prop-2-enylidene]-1H-pyridine
CID 170909813
(2Z)-2-(3-methylbutylidene)-1H-pyridine
CID 143595201
ethyl (2E)-2-(1H-pyridin-2-ylidene)acetate
CID 154723056
2-(3,3-diphenylpropylidene)-1H-pyridine
CID 72563115
2-(dibromomethylidene)-1H-pyridine
CID 167443369
ethene;2-(1H-pyridin-2-ylidene)-1H-pyridine
CID 175098861
cyclopenta-2,4-dien-1-ylidenemethanol fluoride
CID 139243616
(2Z)-2-[(3-ethyl-4,5-dimethyl-2H-imidazol-1-yl)methylidene]-1H-pyridine
CID 166540804
(3-chloro-1H-azepin-2-yl)methanol
CID 168865515
(2Z)-2-hexa-3,4-dien-2-ylidene-1H-pyridine
CID 177235689
1H-1-benzazepine-7,8-diol
CID 20635031

Frequently Asked Questions

What is the IUPAC name of 1H-pyridin-2-ylidenemethanol?
The IUPAC name of 1H-pyridin-2-ylidenemethanol (CID 154723052) is 1H-pyridin-2-ylidenemethanol.
What is the SMILES notation for 1H-pyridin-2-ylidenemethanol?
The canonical SMILES for 1H-pyridin-2-ylidenemethanol is OC=C1C=CC=CN1.
What is the InChIKey of 1H-pyridin-2-ylidenemethanol?
The InChIKey is LEJLNWUGHZBJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO/c8-5-6-3-1-2-4-7-6/h1-5,7-8H.
What are the key properties of 1H-pyridin-2-ylidenemethanol?
1H-pyridin-2-ylidenemethanol has a molecular weight of 109.13 g/mol, XLogP of 1.06, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyridin-2-ylidenemethanol is sourced from PubChem (CID 154723052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).