6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide

C10H12ClN3O2 — CID 82726377

IUPAC6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide
SMILESCC1OCCC1NC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C10H12ClN3O2/c1-6-7(4-5-16-6)12-10(15)8-2-3-9(11)14-13-8/h2-3,6-7H,4-5H2,1H3,(H,12,15)
InChIKeyUPFBNXHHSVOLPT-UHFFFAOYSA-N
MW241.68 g/mol
LogP1.04
Rot. Bonds2

About 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide

6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide (PubChem CID 82726377) has the molecular formula C10H12ClN3O2 and a molecular weight of 241.68 g/mol. Its IUPAC name is 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide
PubChem CID82726377
Molecular FormulaC10H12ClN3O2
Molecular Weight241.68 g/mol
Exact Mass241.06
IUPAC Name6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide
SMILESCC1OCCC1NC(=O)c1ccc(Cl)nn1
InChIInChI=1S/C10H12ClN3O2/c1-6-7(4-5-16-6)12-10(15)8-2-3-9(11)14-13-8/h2-3,6-7H,4-5H2,1H3,(H,12,15)
InChIKeyUPFBNXHHSVOLPT-UHFFFAOYSA-N
XLogP1.04
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.68
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(2-methyloxolan-3-yl)pyridine-3-carboxamide
CID 82726478
4-chloro-N-(2-methyloxolan-3-yl)pyridine-2-carboxamide
CID 82725262
2-chloro-N-(2-methyloxolan-3-yl)furan-3-carboxamide
CID 106687114
6-chloro-N-cyclobutylpyridazine-3-carboxamide
CID 62416339
6-[(2-methyloxolan-3-yl)carbamoyl]pyridine-2-carboxylic acid
CID 82737181
N-(2-methyloxolan-3-yl)-5-(propylamino)pyridine-2-carboxamide
CID 104641948
N-(1-azabicyclo[2.2.2]octan-3-yl)-6-chloropyridazine-3-carboxamide
CID 60858694
6-fluoro-N-(2-methyloxolan-3-yl)pyridine-2-carboxamide
CID 82726069
6-chloro-N-(2,2-dimethyloxan-4-yl)pyridazine-3-carboxamide
CID 83033818
2,5-dichloro-N-(2-methyloxolan-3-yl)pyridine-4-carboxamide
CID 114918773
2-chloro-N-(2-methyloxolan-3-yl)quinoline-4-carboxamide
CID 82725051
3-chloro-4-iodo-N-(2-methyloxolan-3-yl)benzamide
CID 103872396

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide?
The IUPAC name of 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide (CID 82726377) is 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide?
The canonical SMILES for 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide is CC1OCCC1NC(=O)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide?
The InChIKey is UPFBNXHHSVOLPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN3O2/c1-6-7(4-5-16-6)12-10(15)8-2-3-9(11)14-13-8/h2-3,6-7H,4-5H2,1H3,(H,12,15).
What are the key properties of 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide?
6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide has a molecular weight of 241.68 g/mol, XLogP of 1.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 82726377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).