5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one

C10H15N3O — CID 106548752

IUPAC5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
SMILESCc1cnn(C[C@H]2CCCN2)c(=O)c1
InChIInChI=1S/C10H15N3O/c1-8-5-10(14)13(12-6-8)7-9-3-2-4-11-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m1/s1
InChIKeyMMVMZQJEMSPIKC-SECBINFHSA-N
MW193.25 g/mol
LogP0.30
Rot. Bonds2

About 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one

5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one (PubChem CID 106548752) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one.

Molecular Properties

Compound Name5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
PubChem CID106548752
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
SMILESCc1cnn(C[C@H]2CCCN2)c(=O)c1
InChIInChI=1S/C10H15N3O/c1-8-5-10(14)13(12-6-8)7-9-3-2-4-11-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m1/s1
InChIKeyMMVMZQJEMSPIKC-SECBINFHSA-N
XLogP0.30
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-pyrrolidin-1-yl-2-(pyrrolidin-2-ylmethyl)pyridazin-3-one
CID 114395863
2-(cyclopropylmethyl)-5-methylpyridazin-3-one
CID 131020040
5-morpholin-4-yl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819931
5-[ethyl(methyl)amino]-2-(piperidin-2-ylmethyl)pyridazin-3-one
CID 114395928
5-(3-methoxypyrrolidin-1-yl)-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one
CID 102819951
4-(4-methylphenyl)-1-[1-[[(2S)-pyrrolidin-2-yl]methyl]indazol-5-yl]pyridin-2-one
CID 71039147
5-bromo-1-(pyrrolidin-2-ylmethyl)pyrazol-4-ol
CID 117232255
3,5-dimethyl-2-(pyrrolidin-2-ylmethyl)indazole
CID 84793009
4-(3-bromo-4-methylphenyl)-5-methyl-1-(pyrrolidin-2-ylmethyl)pyrazole
CID 84609990
3-(pyrrolidin-2-ylmethyl)pyrido[3,4-d]pyridazin-4-one
CID 102548974
5-(diethylamino)-2-(3-pyrrolidin-2-ylpropyl)pyridazin-3-one
CID 114395947
7-methyl-3-[[(2R)-pyrrolidin-2-yl]methyl]pyrazolo[5,4-d]triazin-4-one
CID 102819861

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
The IUPAC name of 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one (CID 106548752) is 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one.
What is the SMILES notation for 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
The canonical SMILES for 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one is Cc1cnn(C[C@H]2CCCN2)c(=O)c1.
What is the InChIKey of 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
The InChIKey is MMVMZQJEMSPIKC-SECBINFHSA-N. The full InChI is InChI=1S/C10H15N3O/c1-8-5-10(14)13(12-6-8)7-9-3-2-4-11-9/h5-6,9,11H,2-4,7H2,1H3/t9-/m1/s1.
What are the key properties of 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one?
5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one has a molecular weight of 193.25 g/mol, XLogP of 0.30, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[[(2R)-pyrrolidin-2-yl]methyl]pyridazin-3-one is sourced from PubChem (CID 106548752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).