6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one

C18H24N4O2 — CID 126865404

IUPAC6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one
SMILESCc1ocnc1CN1CCC(Cn2nc(C3CC3)ccc2=O)CC1
InChIInChI=1S/C18H24N4O2/c1-13-17(19-12-24-13)11-21-8-6-14(7-9-21)10-22-18(23)5-4-16(20-22)15-2-3-15/h4-5,12,14-15H,2-3,6-11H2,1H3
InChIKeyAUMWCSXDKPKHGL-UHFFFAOYSA-N
MW328.42 g/mol
LogP2.33
Rot. Bonds5

About 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one

6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one (PubChem CID 126865404) has the molecular formula C18H24N4O2 and a molecular weight of 328.42 g/mol. Its IUPAC name is 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one.

Molecular Properties

Compound Name6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one
PubChem CID126865404
Molecular FormulaC18H24N4O2
Molecular Weight328.42 g/mol
Exact Mass328.19
IUPAC Name6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one
SMILESCc1ocnc1CN1CCC(Cn2nc(C3CC3)ccc2=O)CC1
InChIInChI=1S/C18H24N4O2/c1-13-17(19-12-24-13)11-21-8-6-14(7-9-21)10-22-18(23)5-4-16(20-22)15-2-3-15/h4-5,12,14-15H,2-3,6-11H2,1H3
InChIKeyAUMWCSXDKPKHGL-UHFFFAOYSA-N
XLogP2.33
TPSA64.16 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one with MolForge

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Related Compounds

CID 171994193
CID 171994193
CID 172881310
CID 172881310
CID 126862480
CID 126862480
CID 126862481
CID 126862481
CID 126862483
CID 126862483
CID 126862948
CID 126862948
CID 126862949
CID 126862949
CID 126864084
CID 126864084
CID 126864085
CID 126864085
CID 126864087
CID 126864087
CID 126864944
CID 126864944
CID 126864945
CID 126864945

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one?
The IUPAC name of 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one (CID 126865404) is 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one.
What is the SMILES notation for 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one?
The canonical SMILES for 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one is Cc1ocnc1CN1CCC(Cn2nc(C3CC3)ccc2=O)CC1.
What is the InChIKey of 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one?
The InChIKey is AUMWCSXDKPKHGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2/c1-13-17(19-12-24-13)11-21-8-6-14(7-9-21)10-22-18(23)5-4-16(20-22)15-2-3-15/h4-5,12,14-15H,2-3,6-11H2,1H3.
What are the key properties of 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one?
6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one has a molecular weight of 328.42 g/mol, XLogP of 2.33, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-2-[[1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]pyridazin-3-one is sourced from PubChem (CID 126865404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).