6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one

C20H25N5O — CID 126927603

IUPAC6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one
SMILESCC1CCc2nnc(N3CC(Cn4nc(C5CC5)ccc4=O)C3)cc2C1
InChIInChI=1S/C20H25N5O/c1-13-2-5-17-16(8-13)9-19(22-21-17)24-10-14(11-24)12-25-20(26)7-6-18(23-25)15-3-4-15/h6-7,9,13-15H,2-5,8,10-12H2,1H3
InChIKeyKENITMWVBMEVPF-UHFFFAOYSA-N
MW351.45 g/mol
LogP2.17
Rot. Bonds4

About 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one

6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one (PubChem CID 126927603) has the molecular formula C20H25N5O and a molecular weight of 351.45 g/mol. Its IUPAC name is 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one.

Molecular Properties

Compound Name6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one
PubChem CID126927603
Molecular FormulaC20H25N5O
Molecular Weight351.45 g/mol
Exact Mass351.21
IUPAC Name6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one
SMILESCC1CCc2nnc(N3CC(Cn4nc(C5CC5)ccc4=O)C3)cc2C1
InChIInChI=1S/C20H25N5O/c1-13-2-5-17-16(8-13)9-19(22-21-17)24-10-14(11-24)12-25-20(26)7-6-18(23-25)15-3-4-15/h6-7,9,13-15H,2-5,8,10-12H2,1H3
InChIKeyKENITMWVBMEVPF-UHFFFAOYSA-N
XLogP2.17
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one with MolForge

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Related Compounds

6-tert-butyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)piperidin-4-yl]methyl]pyridazin-3-one
CID 126862656
6-cyclopropyl-2-[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one
CID 126927367
3-[3-[(4-bromopyrazol-1-yl)methyl]azetidin-1-yl]-6-methyl-5,6,7,8-tetrahydrocinnoline
CID 165434706
2-[[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]methyl]-6-pyridin-4-ylpyridazin-3-one
CID 126929722
6-tert-butyl-2-[2-[4-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)piperazin-1-yl]ethyl]pyridazin-3-one
CID 126914330
(3R)-1-[(6S)-6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl]pyrrolidin-3-amine
CID 99978361
6-cyclopropyl-2-[(1-pyrimidin-2-ylazetidin-3-yl)methyl]pyridazin-3-one
CID 126927310
2-[[1-(6-cyclopropylpyridazin-3-yl)azetidin-3-yl]methyl]-6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-one
CID 126930075
6-cyclopropyl-2-[[1-(5-cyclopropylpyrimidin-2-yl)azetidin-3-yl]methyl]pyridazin-3-one
CID 126927532
3-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)piperidin-4-yl]methyl]-6-propan-2-ylpyrimidin-4-one
CID 126942453
6-cyclopropyl-2-[[1-(3-methylquinoxalin-2-yl)azetidin-3-yl]methyl]pyridazin-3-one
CID 126927356
6-cyclopropyl-2-[[1-[(1-methyl-6-oxopiperidin-3-yl)methyl]azetidin-3-yl]methyl]pyridazin-3-one
CID 126927503

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one?
The IUPAC name of 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one (CID 126927603) is 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one.
What is the SMILES notation for 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one?
The canonical SMILES for 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one is CC1CCc2nnc(N3CC(Cn4nc(C5CC5)ccc4=O)C3)cc2C1.
What is the InChIKey of 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one?
The InChIKey is KENITMWVBMEVPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O/c1-13-2-5-17-16(8-13)9-19(22-21-17)24-10-14(11-24)12-25-20(26)7-6-18(23-25)15-3-4-15/h6-7,9,13-15H,2-5,8,10-12H2,1H3.
What are the key properties of 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one?
6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one has a molecular weight of 351.45 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-2-[[1-(6-methyl-5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]methyl]pyridazin-3-one is sourced from PubChem (CID 126927603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).