2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide

C17H14N6O — CID 155799652

IUPAC2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide
SMILESCc1cn2nc(C(=O)Nc3ccc(-c4ccn[nH]4)cc3)ccc2n1
InChIInChI=1S/C17H14N6O/c1-11-10-23-16(19-11)7-6-15(22-23)17(24)20-13-4-2-12(3-5-13)14-8-9-18-21-14/h2-10H,1H3,(H,18,21)(H,20,24)
InChIKeyUFBVNFZGCUADPV-UHFFFAOYSA-N
MW318.34 g/mol
LogP2.68
Rot. Bonds3

About 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide

2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide (PubChem CID 155799652) has the molecular formula C17H14N6O and a molecular weight of 318.34 g/mol. Its IUPAC name is 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide
PubChem CID155799652
Molecular FormulaC17H14N6O
Molecular Weight318.34 g/mol
Exact Mass318.12
IUPAC Name2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide
SMILESCc1cn2nc(C(=O)Nc3ccc(-c4ccn[nH]4)cc3)ccc2n1
InChIInChI=1S/C17H14N6O/c1-11-10-23-16(19-11)7-6-15(22-23)17(24)20-13-4-2-12(3-5-13)14-8-9-18-21-14/h2-10H,1H3,(H,18,21)(H,20,24)
InChIKeyUFBVNFZGCUADPV-UHFFFAOYSA-N
XLogP2.68
TPSA87.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.34
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,5-dimethyl-N-[4-(1H-pyrazol-5-yl)phenyl]pyrazole-3-carboxamide
CID 61069082
N-(2-chlorophenyl)-2-methylimidazo[1,2-b]pyridazine-6-carboxamide
CID 155799171
2-methyl-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide
CID 155799487
6-methoxy-N-[4-(1H-pyrazol-5-yl)phenyl]pyrimidine-4-carboxamide
CID 121167435
N-(3,5-difluorophenyl)-6-(1H-pyrazol-5-yl)imidazo[1,2-a]pyridine-2-carboxamide
CID 68780655
2-cyclopropyl-N-(4-methoxyphenyl)imidazo[1,2-b]pyridazine-6-carboxamide
CID 154854035
4-bromo-1-propan-2-yl-N-[4-(1H-pyrazol-5-yl)phenyl]pyrrole-2-carboxamide
CID 78895551
3-oxo-N-[4-(1H-pyrazol-5-yl)phenyl]butanamide
CID 61248448
3-amino-2,2-dimethyl-N-[4-(1H-pyrazol-5-yl)phenyl]propanamide
CID 81470210
N-[4-(1H-pyrazol-5-yl)phenyl]prop-2-ynamide
CID 61284929
2-bromo-N-[4-(1H-pyrazol-5-yl)phenyl]furan-3-carboxamide
CID 106853299
2-oxo-N-[4-(1H-pyrazol-5-yl)phenyl]-1H-pyridine-4-carboxamide
CID 103763782

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide?
The IUPAC name of 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide (CID 155799652) is 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide?
The canonical SMILES for 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide is Cc1cn2nc(C(=O)Nc3ccc(-c4ccn[nH]4)cc3)ccc2n1.
What is the InChIKey of 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide?
The InChIKey is UFBVNFZGCUADPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N6O/c1-11-10-23-16(19-11)7-6-15(22-23)17(24)20-13-4-2-12(3-5-13)14-8-9-18-21-14/h2-10H,1H3,(H,18,21)(H,20,24).
What are the key properties of 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide?
2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide has a molecular weight of 318.34 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-(1H-pyrazol-5-yl)phenyl]imidazo[1,2-b]pyridazine-6-carboxamide is sourced from PubChem (CID 155799652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).