N-(oxetan-2-yl)pyridazine-3-carboxamide

C8H9N3O2 — CID 175943968

IUPACN-(oxetan-2-yl)pyridazine-3-carboxamide
SMILESO=C(NC1CCO1)c1cccnn1
InChIInChI=1S/C8H9N3O2/c12-8(10-7-3-5-13-7)6-2-1-4-9-11-6/h1-2,4,7H,3,5H2,(H,10,12)
InChIKeyMBGUDYQFUDNRJV-UHFFFAOYSA-N
MW179.18 g/mol
LogP-0.05
Rot. Bonds2

About N-(oxetan-2-yl)pyridazine-3-carboxamide

N-(oxetan-2-yl)pyridazine-3-carboxamide (PubChem CID 175943968) has the molecular formula C8H9N3O2 and a molecular weight of 179.18 g/mol. Its IUPAC name is N-(oxetan-2-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(oxetan-2-yl)pyridazine-3-carboxamide
PubChem CID175943968
Molecular FormulaC8H9N3O2
Molecular Weight179.18 g/mol
Exact Mass179.07
IUPAC NameN-(oxetan-2-yl)pyridazine-3-carboxamide
SMILESO=C(NC1CCO1)c1cccnn1
InChIInChI=1S/C8H9N3O2/c12-8(10-7-3-5-13-7)6-2-1-4-9-11-6/h1-2,4,7H,3,5H2,(H,10,12)
InChIKeyMBGUDYQFUDNRJV-UHFFFAOYSA-N
XLogP-0.05
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.18
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-hydroxycyclohexyl)pyridazine-3-carboxamide
CID 141460592
N-[4-(difluoromethyl)cyclohexyl]pyridazine-3-carboxamide
CID 136555200
N-(1,1-dioxothiolan-3-yl)pyridazine-3-carboxamide
CID 110852783
N-(cyclopropylmethyl)pyridazine-3-carboxamide
CID 158437543
N-(2-cyclopropylethyl)pyridazine-3-carboxamide;hydrochloride
CID 141153348
N-phenylpyridazine-3-carboxamide
CID 23633015
N-propylpyridazine-3-carboxamide
CID 89418818
6-chloro-N-(2-methyloxolan-3-yl)pyridazine-3-carboxamide
CID 82726377
N-pentylpyridazine-3-carboxamide;hydrochloride
CID 143205726
6-fluoro-N-(2-methyloxolan-3-yl)pyridine-2-carboxamide
CID 82726069
N-[4-(aminomethyl)-4-(3-chlorophenyl)cyclohexyl]pyridazine-3-carboxamide
CID 70296559
N-butan-2-ylpyridazine-3-carboxamide
CID 110848472

Frequently Asked Questions

What is the IUPAC name of N-(oxetan-2-yl)pyridazine-3-carboxamide?
The IUPAC name of N-(oxetan-2-yl)pyridazine-3-carboxamide (CID 175943968) is N-(oxetan-2-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-(oxetan-2-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-(oxetan-2-yl)pyridazine-3-carboxamide is O=C(NC1CCO1)c1cccnn1.
What is the InChIKey of N-(oxetan-2-yl)pyridazine-3-carboxamide?
The InChIKey is MBGUDYQFUDNRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2/c12-8(10-7-3-5-13-7)6-2-1-4-9-11-6/h1-2,4,7H,3,5H2,(H,10,12).
What are the key properties of N-(oxetan-2-yl)pyridazine-3-carboxamide?
N-(oxetan-2-yl)pyridazine-3-carboxamide has a molecular weight of 179.18 g/mol, XLogP of -0.05, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxetan-2-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 175943968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).