2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide

C14H24N4O — CID 113044508

IUPAC2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide
SMILESCC(C)CCNc1ccc(NC(=O)C(C)(C)C)nn1
InChIInChI=1S/C14H24N4O/c1-10(2)8-9-15-11-6-7-12(18-17-11)16-13(19)14(3,4)5/h6-7,10H,8-9H2,1-5H3,(H,15,17)(H,16,18,19)
InChIKeyBYYFBXHXAMGOTL-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.92
Rot. Bonds5

About 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide

2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide (PubChem CID 113044508) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide
PubChem CID113044508
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide
SMILESCC(C)CCNc1ccc(NC(=O)C(C)(C)C)nn1
InChIInChI=1S/C14H24N4O/c1-10(2)8-9-15-11-6-7-12(18-17-11)16-13(19)14(3,4)5/h6-7,10H,8-9H2,1-5H3,(H,15,17)(H,16,18,19)
InChIKeyBYYFBXHXAMGOTL-UHFFFAOYSA-N
XLogP2.92
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]benzamide
CID 113044515
2-methyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]benzamide
CID 113044513
4-methoxy-N-[6-(3-methylbutylamino)pyridazin-3-yl]benzamide
CID 113044524
6-(3-methylbutylamino)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111229
6-(3-methylbutylamino)-N-phenylpyridazine-3-carboxamide
CID 109125155
3,4,5-trimethoxy-N-[6-(3-methylbutylamino)pyridazin-3-yl]benzamide
CID 113044532
N-(2-tert-butylphenyl)-6-(3-methylbutylamino)pyridazine-3-carboxamide
CID 109125175
N-(4-bromophenyl)-6-(3-methylbutylamino)pyridazine-3-carboxamide
CID 109125190
[6-(3-methylbutylamino)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
CID 109111959
N-[6-[(2-chlorophenyl)methylamino]pyridazin-3-yl]-2,2-dimethylpropanamide
CID 113041532
N-[6-(butylamino)pyridazin-3-yl]-3-methylbutanamide
CID 113038313
N-(2,5-dichlorophenyl)-6-(3-methylbutylamino)pyridazine-3-carboxamide
CID 109125242

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide (CID 113044508) is 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide is CC(C)CCNc1ccc(NC(=O)C(C)(C)C)nn1.
What is the InChIKey of 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide?
The InChIKey is BYYFBXHXAMGOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-10(2)8-9-15-11-6-7-12(18-17-11)16-13(19)14(3,4)5/h6-7,10H,8-9H2,1-5H3,(H,15,17)(H,16,18,19).
What are the key properties of 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide?
2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide has a molecular weight of 264.37 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[6-(3-methylbutylamino)pyridazin-3-yl]propanamide is sourced from PubChem (CID 113044508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).