6-methyl-N-propylpyridazine-3-carboxamide

C9H13N3O — CID 110705181

IUPAC6-methyl-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1ccc(C)nn1
InChIInChI=1S/C9H13N3O/c1-3-6-10-9(13)8-5-4-7(2)11-12-8/h4-5H,3,6H2,1-2H3,(H,10,13)
InChIKeyDXZURVQSYQLNIV-UHFFFAOYSA-N
MW179.22 g/mol
LogP0.92
Rot. Bonds3

About 6-methyl-N-propylpyridazine-3-carboxamide

6-methyl-N-propylpyridazine-3-carboxamide (PubChem CID 110705181) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is 6-methyl-N-propylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-propylpyridazine-3-carboxamide
PubChem CID110705181
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC Name6-methyl-N-propylpyridazine-3-carboxamide
SMILESCCCNC(=O)c1ccc(C)nn1
InChIInChI=1S/C9H13N3O/c1-3-6-10-9(13)8-5-4-7(2)11-12-8/h4-5H,3,6H2,1-2H3,(H,10,13)
InChIKeyDXZURVQSYQLNIV-UHFFFAOYSA-N
XLogP0.92
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)propyl]-6-methylpyridazine-3-carboxamide
CID 110705198
N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
N-(2-hydroxy-2-methylpropyl)-6-methylpyridazine-3-carboxamide
CID 118545198
N-[(2S)-2-hydroxypropyl]-6-methylpyridazine-3-carboxamide
CID 131169237
6-(dipropylamino)-N-propylpyridazine-3-carboxamide
CID 109109285
6-(3,5-dimethylanilino)-N-propylpyridazine-3-carboxamide
CID 109109300
N-[2-(4-methoxyphenyl)ethyl]-6-methylpyridazine-3-carboxamide
CID 110705227
N-propylpyridazine-3-carboxamide
CID 89418818
6-(cyclopropylamino)-N-propylpyridazine-3-carboxamide
CID 109109200
N-[2-(2-methoxyphenyl)ethyl]-6-methylpyridazine-3-carboxamide
CID 110705225
6-(prop-2-enylamino)-N-propylpyridazine-3-carboxamide
CID 109109201
5-methyl-N-propylpyrazine-2-carboxamide
CID 60637750

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propylpyridazine-3-carboxamide?
The IUPAC name of 6-methyl-N-propylpyridazine-3-carboxamide (CID 110705181) is 6-methyl-N-propylpyridazine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-propylpyridazine-3-carboxamide?
The canonical SMILES for 6-methyl-N-propylpyridazine-3-carboxamide is CCCNC(=O)c1ccc(C)nn1.
What is the InChIKey of 6-methyl-N-propylpyridazine-3-carboxamide?
The InChIKey is DXZURVQSYQLNIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-3-6-10-9(13)8-5-4-7(2)11-12-8/h4-5H,3,6H2,1-2H3,(H,10,13).
What are the key properties of 6-methyl-N-propylpyridazine-3-carboxamide?
6-methyl-N-propylpyridazine-3-carboxamide has a molecular weight of 179.22 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propylpyridazine-3-carboxamide is sourced from PubChem (CID 110705181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).