1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine

C10H12N4 — CID 153487651

IUPAC1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine
SMILESCc1nnc(C)c2c1cnn2C1CC1
InChIInChI=1S/C10H12N4/c1-6-9-5-11-14(8-3-4-8)10(9)7(2)13-12-6/h5,8H,3-4H2,1-2H3
InChIKeyKGLZIVVQLZBEDE-UHFFFAOYSA-N
MW188.23 g/mol
LogP1.78
Rot. Bonds1

About 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine

1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine (PubChem CID 153487651) has the molecular formula C10H12N4 and a molecular weight of 188.23 g/mol. Its IUPAC name is 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine.

Molecular Properties

Compound Name1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine
PubChem CID153487651
Molecular FormulaC10H12N4
Molecular Weight188.23 g/mol
Exact Mass188.11
IUPAC Name1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine
SMILESCc1nnc(C)c2c1cnn2C1CC1
InChIInChI=1S/C10H12N4/c1-6-9-5-11-14(8-3-4-8)10(9)7(2)13-12-6/h5,8H,3-4H2,1-2H3
InChIKeyKGLZIVVQLZBEDE-UHFFFAOYSA-N
XLogP1.78
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-chloro-1,3-dimethyl-1H-pyrazolo(3,4-d)pyridazine
CID 121552891
2-Ethylpyrazolo[3,4-c]pyridine
CID 148322778
1-Cyclohexyl-7-fluoro-3-methylpyrazolo[4,3-c]pyridine
CID 130336019
(2Z,4Z,6Z)-5-(1-aminoethenyl)-6-N-(7-ethyl-1-methylpyrazolo[5,4-c]pyridin-4-yl)-3-fluoroocta-2,4,6-triene-2,6-diamine
CID 134187790
4-Fluoro-3-iodo-1,5-dimethylpyrazolo[3,4-c]pyridine
CID 134337154
2-(Difluoromethyl)-5-methylpyrazolo[3,4-c]pyridine
CID 164548591
Ethane;[1-(2,2,2-trifluoroethyl)pyrazolo[3,4-c]pyridin-5-yl]methanimine
CID 165403043
Ethane;[1-(2,2,2-trifluoroethyl)pyrazolo[3,4-c]pyridin-5-yl]methanamine
CID 165403161
[1-(2,2-Difluoropropyl)pyrazolo[3,4-c]pyridin-5-yl]methanamine
CID 165403188
(1R)-1-[1-[(1-fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]ethanamine
CID 165403204
[1-[(1-Fluorocyclopropyl)methyl]pyrazolo[3,4-c]pyridin-5-yl]methanamine
CID 165403253
[(1R)-1-[1-(2,2-difluoropropyl)pyrazolo[3,4-c]pyridin-5-yl]ethyl]-methylidyneazanium
CID 171517584

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine?
The IUPAC name of 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine (CID 153487651) is 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine.
What is the SMILES notation for 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine?
The canonical SMILES for 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine is Cc1nnc(C)c2c1cnn2C1CC1.
What is the InChIKey of 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine?
The InChIKey is KGLZIVVQLZBEDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4/c1-6-9-5-11-14(8-3-4-8)10(9)7(2)13-12-6/h5,8H,3-4H2,1-2H3.
What are the key properties of 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine?
1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine has a molecular weight of 188.23 g/mol, XLogP of 1.78, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-4,7-dimethylpyrazolo[3,4-d]pyridazine is sourced from PubChem (CID 153487651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).