6-methoxy-N-propan-2-ylpyridazine-3-carboxamide

C9H13N3O2 — CID 129166823

IUPAC6-methoxy-N-propan-2-ylpyridazine-3-carboxamide
SMILESCOc1ccc(C(=O)NC(C)C)nn1
InChIInChI=1S/C9H13N3O2/c1-6(2)10-9(13)7-4-5-8(14-3)12-11-7/h4-6H,1-3H3,(H,10,13)
InChIKeyNSUXBBDMJAMTED-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.62
Rot. Bonds3

About 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide

6-methoxy-N-propan-2-ylpyridazine-3-carboxamide (PubChem CID 129166823) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-propan-2-ylpyridazine-3-carboxamide
PubChem CID129166823
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name6-methoxy-N-propan-2-ylpyridazine-3-carboxamide
SMILESCOc1ccc(C(=O)NC(C)C)nn1
InChIInChI=1S/C9H13N3O2/c1-6(2)10-9(13)7-4-5-8(14-3)12-11-7/h4-6H,1-3H3,(H,10,13)
InChIKeyNSUXBBDMJAMTED-UHFFFAOYSA-N
XLogP0.62
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2R,3R)-1-hydroxy-3-methylpentan-2-yl]-6-methoxypyridazine-3-carboxamide
CID 97332692
N-ethyl-6-methoxypyridazine-3-carboxamide
CID 90509402
N-(2-amino-2-oxoethyl)-6-methoxypyridazine-3-carboxamide
CID 90509437
N-cycloheptyl-6-methoxypyridazine-3-carboxamide
CID 90509309
N-cyclohexyl-6-methoxypyridazine-3-carboxamide
CID 90509273
6-[(4-methoxyphenyl)methylamino]-N-propan-2-ylpyridazine-3-carboxamide
CID 109109629
6-methoxy-N-(2-methylcyclohexyl)pyridazine-3-carboxamide
CID 90509274
1-(6-methoxypyridazin-3-yl)-4-methylpentan-1-one
CID 103373127
3-(2,4-difluorophenyl)-3-[(6-methoxypyridazine-3-carbonyl)amino]propanoic acid
CID 154795855
6-(2,4-dimethoxyanilino)-N-propan-2-ylpyridazine-3-carboxamide
CID 109109731
N-[(3,5-dimethylphenyl)-pyridin-3-ylmethyl]-6-methoxypyridazine-3-carboxamide
CID 84584365
6-(butylamino)-N-propan-2-ylpyridazine-3-carboxamide
CID 109109597

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide?
The IUPAC name of 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide (CID 129166823) is 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide.
What is the SMILES notation for 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide?
The canonical SMILES for 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide is COc1ccc(C(=O)NC(C)C)nn1.
What is the InChIKey of 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide?
The InChIKey is NSUXBBDMJAMTED-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-6(2)10-9(13)7-4-5-8(14-3)12-11-7/h4-6H,1-3H3,(H,10,13).
What are the key properties of 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide?
6-methoxy-N-propan-2-ylpyridazine-3-carboxamide has a molecular weight of 195.22 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-propan-2-ylpyridazine-3-carboxamide is sourced from PubChem (CID 129166823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).