N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide

C15H25N5O — CID 109116180

IUPACN-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide
SMILESCCCCN(C)C(=O)c1ccc(N2CCN(C)CC2)nn1
InChIInChI=1S/C15H25N5O/c1-4-5-8-19(3)15(21)13-6-7-14(17-16-13)20-11-9-18(2)10-12-20/h6-7H,4-5,8-12H2,1-3H3
InChIKeySUYMLJHKZMOAFR-UHFFFAOYSA-N
MW291.40 g/mol
LogP1.10
Rot. Bonds5

About N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide

N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide (PubChem CID 109116180) has the molecular formula C15H25N5O and a molecular weight of 291.40 g/mol. Its IUPAC name is N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide
PubChem CID109116180
Molecular FormulaC15H25N5O
Molecular Weight291.40 g/mol
Exact Mass291.21
IUPAC NameN-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide
SMILESCCCCN(C)C(=O)c1ccc(N2CCN(C)CC2)nn1
InChIInChI=1S/C15H25N5O/c1-4-5-8-19(3)15(21)13-6-7-14(17-16-13)20-11-9-18(2)10-12-20/h6-7H,4-5,8-12H2,1-3H3
InChIKeySUYMLJHKZMOAFR-UHFFFAOYSA-N
XLogP1.10
TPSA52.57 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-6-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methylpyridazine-3-carboxamide
CID 109121746
N-butyl-6-[4-(furan-2-carbonyl)piperazin-1-yl]-N-methylpyridazine-3-carboxamide
CID 109124073
6-(4-phenylpiperazin-1-yl)-N,N-dipropylpyridazine-3-carboxamide
CID 109123102
6-(4-formylpiperazin-1-yl)-N,N-dipropylpyridazine-3-carboxamide
CID 109116830
N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109124196
[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
CID 109111898
N-benzyl-N-methyl-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 71778492
N-butyl-N-methyl-5-pyrrolidin-1-ylpyridine-2-carboxamide
CID 109182041
6-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N-dipropylpyridazine-3-carboxamide
CID 109123968
N-butyl-N-methyl-6-(pentylamino)pyridazine-3-carboxamide
CID 109125364
N-butyl-N-methyl-3-(4-methylpiperazin-1-yl)indolizine-6-carboxamide
CID 97362385
6-(azepan-1-yl)-N-butyl-N,2-dimethylpyrimidine-4-carboxamide
CID 112847027

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide (CID 109116180) is N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide is CCCCN(C)C(=O)c1ccc(N2CCN(C)CC2)nn1.
What is the InChIKey of N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide?
The InChIKey is SUYMLJHKZMOAFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5O/c1-4-5-8-19(3)15(21)13-6-7-14(17-16-13)20-11-9-18(2)10-12-20/h6-7H,4-5,8-12H2,1-3H3.
What are the key properties of N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide?
N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide has a molecular weight of 291.40 g/mol, XLogP of 1.10, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 109116180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).