N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide

C14H25N5O — CID 62177462

IUPACN-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NCC(C)(C)N(C)C)nn1
InChIInChI=1S/C14H25N5O/c1-6-9-15-12-8-7-11(17-18-12)13(20)16-10-14(2,3)19(4)5/h7-8H,6,9-10H2,1-5H3,(H,15,18)(H,16,20)
InChIKeyUMTPDMWDDSFILX-UHFFFAOYSA-N
MW279.39 g/mol
LogP1.37
Rot. Bonds7

About N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide

N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide (PubChem CID 62177462) has the molecular formula C14H25N5O and a molecular weight of 279.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide
PubChem CID62177462
Molecular FormulaC14H25N5O
Molecular Weight279.39 g/mol
Exact Mass279.21
IUPAC NameN-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide
SMILESCCCNc1ccc(C(=O)NCC(C)(C)N(C)C)nn1
InChIInChI=1S/C14H25N5O/c1-6-9-15-12-8-7-11(17-18-12)13(20)16-10-14(2,3)19(4)5/h7-8H,6,9-10H2,1-5H3,(H,15,18)(H,16,20)
InChIKeyUMTPDMWDDSFILX-UHFFFAOYSA-N
XLogP1.37
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62172507
N-(2,2-dimethylpropyl)-N-methyl-6-(propylamino)pyridazine-3-carboxamide
CID 62178802
N-methyl-N-propyl-6-(propylamino)pyridazine-3-carboxamide
CID 62169151
N-[3-(methylamino)-3-oxopropyl]-6-(propylamino)pyridazine-3-carboxamide
CID 62175032
N-[2-(dimethylamino)-2-methylpropyl]-2-(propylamino)pyridine-4-carboxamide
CID 62177285
6-(butylamino)-N-[2-(dimethylamino)ethyl]pyridazine-3-carboxamide
CID 109110589
N-(2-phenylethyl)-6-(propylamino)pyridazine-3-carboxamide
CID 62167760
N-[2-(dimethylamino)ethyl]-6-[2-(dimethylamino)ethylamino]pyridazine-3-carboxamide
CID 109115146
N-(2-methoxyethyl)-N-methyl-6-(propylamino)pyridazine-3-carboxamide
CID 62177414
N-[2-(methylsulfamoyl)ethyl]-6-(propylamino)pyridazine-3-carboxamide
CID 106342494
N-[3-(dimethylamino)propyl]-6-[3-(dimethylamino)propylamino]pyridazine-3-carboxamide
CID 109115782
N-(2-tert-butylphenyl)-6-(propylamino)pyridazine-3-carboxamide
CID 109109147

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide (CID 62177462) is N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide is CCCNc1ccc(C(=O)NCC(C)(C)N(C)C)nn1.
What is the InChIKey of N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide?
The InChIKey is UMTPDMWDDSFILX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O/c1-6-9-15-12-8-7-11(17-18-12)13(20)16-10-14(2,3)19(4)5/h7-8H,6,9-10H2,1-5H3,(H,15,18)(H,16,20).
What are the key properties of N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide?
N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide has a molecular weight of 279.39 g/mol, XLogP of 1.37, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-methylpropyl]-6-(propylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 62177462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).