6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde

C10H9N3O — CID 80632831

IUPAC6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde
SMILESCc1cnn(-c2ccc(C=O)cn2)c1
InChIInChI=1S/C10H9N3O/c1-8-4-12-13(6-8)10-3-2-9(7-14)5-11-10/h2-7H,1H3
InChIKeyIEILMBMQBNOMEN-UHFFFAOYSA-N
MW187.20 g/mol
LogP1.39
Rot. Bonds2

About 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde

6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde (PubChem CID 80632831) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde.

Molecular Properties

Compound Name6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde
PubChem CID80632831
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Name6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde
SMILESCc1cnn(-c2ccc(C=O)cn2)c1
InChIInChI=1S/C10H9N3O/c1-8-4-12-13(6-8)10-3-2-9(7-14)5-11-10/h2-7H,1H3
InChIKeyIEILMBMQBNOMEN-UHFFFAOYSA-N
XLogP1.39
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2,5-Dimethyl-1-(4-methylpyridin-2-YL)-1H-pyrrole-3-carbaldehyde
CID 885302
6-(1H-pyrazol-1-yl)pyridine-3-carboxylic acid
CID 2763614
N-(2,4-difluorophenyl)-6-(1H-pyrazol-1-yl)nicotinamide
CID 3567091
N,N-Dimethyl-6-(1H-pyrazol-1-yl)-3-pyridinecarboxamide
CID 3758868
6-(Dimethylamino)pyridine-3-carbaldehyde
CID 11240577
(4-methylpiperazino)[6-(1H-pyrazol-1-yl)-3-pyridinyl]methanone
CID 3758761
N-(4-methylphenyl)-6-(1H-pyrazol-1-yl)nicotinamide
CID 4298772
1H-Pyrazole-4-carboxamide, 5-cyano-N-methoxy-N-methyl-1-(2-pyridinyl)-
CID 163674
1H-Pyrazole-4-carboxamide, 5-cyano-N-methyl-1-(2-pyridinyl)-
CID 175784
1-(Pyridin-2-yl)-1H-pyrazole-4-carbaldehyde
CID 24704893
1,3-dimethyl-1H-pyrazolo[3,4-b]pyridine-5-carbaldehyde
CID 47002145
5-Amino-1-(2-pyridinyl)-1H-pyrazole-4-carboxamide
CID 12151702

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde?
The IUPAC name of 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde (CID 80632831) is 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde.
What is the SMILES notation for 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde?
The canonical SMILES for 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde is Cc1cnn(-c2ccc(C=O)cn2)c1.
What is the InChIKey of 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde?
The InChIKey is IEILMBMQBNOMEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c1-8-4-12-13(6-8)10-3-2-9(7-14)5-11-10/h2-7H,1H3.
What are the key properties of 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde?
6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde has a molecular weight of 187.20 g/mol, XLogP of 1.39, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylpyrazol-1-yl)pyridine-3-carbaldehyde is sourced from PubChem (CID 80632831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).