N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide

C15H19N5O — CID 109120969

IUPACN,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(NCc2cccnc2)nn1
InChIInChI=1S/C15H19N5O/c1-3-20(4-2)15(21)13-7-8-14(19-18-13)17-11-12-6-5-9-16-10-12/h5-10H,3-4,11H2,1-2H3,(H,17,19)
InChIKeyVEJHKBFJZYEKSN-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.97
Rot. Bonds6

About N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide

N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide (PubChem CID 109120969) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
PubChem CID109120969
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC NameN,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(NCc2cccnc2)nn1
InChIInChI=1S/C15H19N5O/c1-3-20(4-2)15(21)13-7-8-14(19-18-13)17-11-12-6-5-9-16-10-12/h5-10H,3-4,11H2,1-2H3,(H,17,19)
InChIKeyVEJHKBFJZYEKSN-UHFFFAOYSA-N
XLogP1.97
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 79005962
N,N-diethyl-6-[(3-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118261
N-propan-2-yl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109109633
N-benzyl-N-ethyl-6-[(4-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118471
6-[(4-methoxyphenyl)methylamino]-N-(pyridin-3-ylmethyl)pyridazine-3-carboxamide
CID 109120160
N-(2-tert-butylphenyl)-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109121006
6-(pyridin-3-ylmethylamino)-N-(2,4,6-trimethylphenyl)pyridazine-3-carboxamide
CID 109121003
2-methyl-N-[6-(pyridin-3-ylmethylamino)pyridazin-3-yl]propanamide
CID 113042074
N-(3,5-dichlorophenyl)-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109121070
N-benzyl-N-ethyl-6-[(4-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109120158
N-cyclohexyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109113007
N-(2-bromophenyl)-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide
CID 109121053

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide?
The IUPAC name of N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide (CID 109120969) is N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide?
The canonical SMILES for N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide is CCN(CC)C(=O)c1ccc(NCc2cccnc2)nn1.
What is the InChIKey of N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide?
The InChIKey is VEJHKBFJZYEKSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-3-20(4-2)15(21)13-7-8-14(19-18-13)17-11-12-6-5-9-16-10-12/h5-10H,3-4,11H2,1-2H3,(H,17,19).
What are the key properties of N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide?
N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-6-(pyridin-3-ylmethylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 109120969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).