6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one

C19H23N5O — CID 126923719

IUPAC6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one
SMILESO=c1ccc(C2CC2)nn1CC1CCCN1c1nccnc1C1CC1
InChIInChI=1S/C19H23N5O/c25-17-8-7-16(13-3-4-13)22-24(17)12-15-2-1-11-23(15)19-18(14-5-6-14)20-9-10-21-19/h7-10,13-15H,1-6,11-12H2
InChIKeyFTJYQUHJTYATOM-UHFFFAOYSA-N
MW337.43 g/mol
LogP2.46
Rot. Bonds5

About 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one

6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one (PubChem CID 126923719) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one.

Molecular Properties

Compound Name6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one
PubChem CID126923719
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC Name6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one
SMILESO=c1ccc(C2CC2)nn1CC1CCCN1c1nccnc1C1CC1
InChIInChI=1S/C19H23N5O/c25-17-8-7-16(13-3-4-13)22-24(17)12-15-2-1-11-23(15)19-18(14-5-6-14)20-9-10-21-19/h7-10,13-15H,1-6,11-12H2
InChIKeyFTJYQUHJTYATOM-UHFFFAOYSA-N
XLogP2.46
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one?
The IUPAC name of 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one (CID 126923719) is 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one.
What is the SMILES notation for 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one?
The canonical SMILES for 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one is O=c1ccc(C2CC2)nn1CC1CCCN1c1nccnc1C1CC1.
What is the InChIKey of 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one?
The InChIKey is FTJYQUHJTYATOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c25-17-8-7-16(13-3-4-13)22-24(17)12-15-2-1-11-23(15)19-18(14-5-6-14)20-9-10-21-19/h7-10,13-15H,1-6,11-12H2.
What are the key properties of 6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one?
6-cyclopropyl-2-[[1-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one has a molecular weight of 337.43 g/mol, XLogP of 2.46, 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-(3-cyclopropylpyrazin-2-yl)pyrrolidin-2-yl]methyl]pyridazin-3-one is sourced from PubChem (CID 126923719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).