6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide

C11H12ClN5O — CID 103005660

IUPAC6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide
SMILESCn1nccc1CCNC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C11H12ClN5O/c1-17-8(5-7-14-17)4-6-13-11(18)9-2-3-10(12)16-15-9/h2-3,5,7H,4,6H2,1H3,(H,13,18)
InChIKeyYOHPBKCXNZZYGK-UHFFFAOYSA-N
MW265.70 g/mol
LogP0.84
Rot. Bonds4

About 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide

6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide (PubChem CID 103005660) has the molecular formula C11H12ClN5O and a molecular weight of 265.70 g/mol. Its IUPAC name is 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide
PubChem CID103005660
Molecular FormulaC11H12ClN5O
Molecular Weight265.70 g/mol
Exact Mass265.07
IUPAC Name6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide
SMILESCn1nccc1CCNC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C11H12ClN5O/c1-17-8(5-7-14-17)4-6-13-11(18)9-2-3-10(12)16-15-9/h2-3,5,7H,4,6H2,1H3,(H,13,18)
InChIKeyYOHPBKCXNZZYGK-UHFFFAOYSA-N
XLogP0.84
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.70
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]-1,3,4-thiadiazole-2-carboxamide
CID 103005665
5-hydrazinyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
CID 103011437
5-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]furan-2-carboxamide
CID 104693705
N-methyl-6-[2-(2-methylpyrazol-3-yl)ethylamino]pyridazine-3-carboxamide
CID 104696061
2-amino-6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-4-carboxamide
CID 104694768
1-methyl-3-[2-(2-methylpyrazol-3-yl)ethyl]urea
CID 104693382
3-chloro-6-(methylamino)-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
CID 103011360
2-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]-6-propylpyridine-4-carboxamide
CID 103005653
4-bromo-N-[2-(2-methylpyrazol-3-yl)ethyl]-1H-pyrrole-2-carboxamide
CID 104694698
6-chloro-N-[2-(dimethylamino)ethyl]pyridazine-3-carboxamide
CID 60859027
2-(aminomethyl)-N-[2-(2-methylpyrazol-3-yl)ethyl]-1,3-thiazole-4-carboxamide
CID 103006505
3-chloro-2-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]propanamide
CID 103005493

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide (CID 103005660) is 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide is Cn1nccc1CCNC(=O)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide?
The InChIKey is YOHPBKCXNZZYGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN5O/c1-17-8(5-7-14-17)4-6-13-11(18)9-2-3-10(12)16-15-9/h2-3,5,7H,4,6H2,1H3,(H,13,18).
What are the key properties of 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide?
6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide has a molecular weight of 265.70 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridazine-3-carboxamide is sourced from PubChem (CID 103005660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).