N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide

C13H15N5O — CID 51107519

IUPACN-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide
SMILESO=C(NCC1CCC1)c1ccc(-n2ccnc2)nn1
InChIInChI=1S/C13H15N5O/c19-13(15-8-10-2-1-3-10)11-4-5-12(17-16-11)18-7-6-14-9-18/h4-7,9-10H,1-3,8H2,(H,15,19)
InChIKeyYAVNZPHGORTFAO-UHFFFAOYSA-N
MW257.30 g/mol
LogP1.19
Rot. Bonds4

About N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide

N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide (PubChem CID 51107519) has the molecular formula C13H15N5O and a molecular weight of 257.30 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide
PubChem CID51107519
Molecular FormulaC13H15N5O
Molecular Weight257.30 g/mol
Exact Mass257.13
IUPAC NameN-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide
SMILESO=C(NCC1CCC1)c1ccc(-n2ccnc2)nn1
InChIInChI=1S/C13H15N5O/c19-13(15-8-10-2-1-3-10)11-4-5-12(17-16-11)18-7-6-14-9-18/h4-7,9-10H,1-3,8H2,(H,15,19)
InChIKeyYAVNZPHGORTFAO-UHFFFAOYSA-N
XLogP1.19
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.30
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-imidazol-1-yl-N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]pyridazine-3-carboxamide
CID 134813299
N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 141463742
N-(cyclopropylmethyl)-6-imidazol-1-ylpyridine-3-carboxamide
CID 47152532
6-imidazol-1-yl-N-[(4-methylphenyl)methyl]pyridazine-3-carboxamide
CID 121114057
N-(cyclopentylmethyl)-6-(1,3-dihydroisoindol-2-yl)pyridazine-3-carboxamide
CID 141336844
6-imidazol-1-yl-N-[3-(2-oxopyrrolidin-1-yl)propyl]pyridazine-3-carboxamide
CID 121114123
N-[3-(4-chlorophenyl)propyl]-6-imidazol-1-ylpyridazine-3-carboxamide
CID 166181539
2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]cyclohexene-1-carboxylic acid
CID 139444254
ethyl 2-[(6-imidazol-1-ylpyridazine-3-carbonyl)amino]cyclopentene-1-carboxylate
CID 139444570
6-imidazol-1-yl-N-pyridin-3-ylpyridazine-3-carboxamide
CID 121114046
N-(4-acetylphenyl)-6-imidazol-1-ylpyridazine-3-carboxamide
CID 121114037
N-(3,5-dimethylphenyl)-6-imidazol-1-ylpyridazine-3-carboxamide
CID 121114061

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide (CID 51107519) is N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide is O=C(NCC1CCC1)c1ccc(-n2ccnc2)nn1.
What is the InChIKey of N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide?
The InChIKey is YAVNZPHGORTFAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O/c19-13(15-8-10-2-1-3-10)11-4-5-12(17-16-11)18-7-6-14-9-18/h4-7,9-10H,1-3,8H2,(H,15,19).
What are the key properties of N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide?
N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide has a molecular weight of 257.30 g/mol, XLogP of 1.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-6-imidazol-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 51107519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).