N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide

C15H20N4OS — CID 113045135

IUPACN-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide
SMILESCCCN(CCC)c1ccc(NC(=O)c2cccs2)nn1
InChIInChI=1S/C15H20N4OS/c1-3-9-19(10-4-2)14-8-7-13(17-18-14)16-15(20)12-6-5-11-21-12/h5-8,11H,3-4,9-10H2,1-2H3,(H,16,17,20)
InChIKeySCTYJJOBJREITK-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.42
Rot. Bonds7

About N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide

N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide (PubChem CID 113045135) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide
PubChem CID113045135
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC NameN-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide
SMILESCCCN(CCC)c1ccc(NC(=O)c2cccs2)nn1
InChIInChI=1S/C15H20N4OS/c1-3-9-19(10-4-2)14-8-7-13(17-18-14)16-15(20)12-6-5-11-21-12/h5-8,11H,3-4,9-10H2,1-2H3,(H,16,17,20)
InChIKeySCTYJJOBJREITK-UHFFFAOYSA-N
XLogP3.42
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-[(1,1-dioxothiolan-3-yl)-ethylamino]pyridazin-3-yl]thiophene-2-carboxamide
CID 113043476
N-[6-(dipropylamino)pyridazin-3-yl]-3,5-dimethoxybenzamide
CID 113045149
2-(dipropylamino)-5-(thiophene-2-carbonylamino)pyridine-3-carboxylic acid
CID 53094042
N-[6-(3,5-dimethylanilino)pyridazin-3-yl]thiophene-2-carboxamide
CID 113046423
2-(4-bromophenyl)-N-[6-(dipropylamino)pyridazin-3-yl]acetamide
CID 113045186
1-cyclopropyl-3-[6-(dipropylamino)pyridazin-3-yl]urea
CID 113045192
N-[6-(1-phenylethylamino)pyridazin-3-yl]thiophene-2-carboxamide
CID 113041166
ethyl 4-[[6-(thiophene-2-carbonylamino)pyridazin-3-yl]amino]benzoate
CID 113050437
2-(dipropylamino)-5-(thiophene-2-carbonylamino)benzoic acid;2,2,2-trifluoroacetic acid
CID 146060548
N-[6-(3,5-dichloroanilino)pyridazin-3-yl]thiophene-2-carboxamide
CID 113050851
N-[6-(4-fluoroanilino)pyridazin-3-yl]thiophene-2-carboxamide
CID 113047251
N-[6-(3-methoxyanilino)pyridazin-3-yl]thiophene-2-carboxamide
CID 113048189

Frequently Asked Questions

What is the IUPAC name of N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide?
The IUPAC name of N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide (CID 113045135) is N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide?
The canonical SMILES for N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide is CCCN(CCC)c1ccc(NC(=O)c2cccs2)nn1.
What is the InChIKey of N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide?
The InChIKey is SCTYJJOBJREITK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-3-9-19(10-4-2)14-8-7-13(17-18-14)16-15(20)12-6-5-11-21-12/h5-8,11H,3-4,9-10H2,1-2H3,(H,16,17,20).
What are the key properties of N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide?
N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide has a molecular weight of 304.42 g/mol, XLogP of 3.42, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dipropylamino)pyridazin-3-yl]thiophene-2-carboxamide is sourced from PubChem (CID 113045135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).