1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine

C10H15N5 — CID 161483150

IUPAC1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine
SMILESCc1nnc(N)c2c1c(C(C)C)nn2C
InChIInChI=1S/C10H15N5/c1-5(2)8-7-6(3)12-13-10(11)9(7)15(4)14-8/h5H,1-4H3,(H2,11,13)
InChIKeyFKVFCSJPFGTTSK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.38
Rot. Bonds1

About 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine

1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine (PubChem CID 161483150) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine.

Molecular Properties

Compound Name1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine
PubChem CID161483150
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine
SMILESCc1nnc(N)c2c1c(C(C)C)nn2C
InChIInChI=1S/C10H15N5/c1-5(2)8-7-6(3)12-13-10(11)9(7)15(4)14-8/h5H,1-4H3,(H2,11,13)
InChIKeyFKVFCSJPFGTTSK-UHFFFAOYSA-N
XLogP1.38
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-Methyl-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-amine
CID 6481190
1,4,5-Trimethylpyrazolo[5,4-c]pyridazin-3-amine
CID 68652010
1-Methyl-4-propan-2-ylpyrazolo[3,4-c]pyridin-3-amine
CID 69939963
1,3,7-Trimethylpyrrolo[2,3-d]pyridazin-4-amine
CID 89951940
Ethane;1,3,6,7-tetramethylpyrazolo[4,5-c]pyridazine
CID 142348079
2,3,4-Trimethylpyrazolo[3,4-d]pyridazin-7-amine
CID 142486239
N,N,3,4-tetramethyl-2H-pyrazolo[3,4-d]pyridazin-7-amine
CID 153432721
1,4,7-Trimethylpyrazolo[3,4-d]pyridazine
CID 153487606
N,2,3,4-tetramethylpyrazolo[3,4-d]pyridazin-7-amine
CID 153503777
3-Ethyl-1,6-dimethyl-7-propylpyrazolo[4,5-c]pyridazine
CID 163424828
7-Ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine
CID 163561282
7-Ethyl-3-iodo-1,6-dimethylpyrazolo[4,5-c]pyridazine
CID 163971883

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine?
The IUPAC name of 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine (CID 161483150) is 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine.
What is the SMILES notation for 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine?
The canonical SMILES for 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine is Cc1nnc(N)c2c1c(C(C)C)nn2C.
What is the InChIKey of 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine?
The InChIKey is FKVFCSJPFGTTSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-5(2)8-7-6(3)12-13-10(11)9(7)15(4)14-8/h5H,1-4H3,(H2,11,13).
What are the key properties of 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine?
1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine has a molecular weight of 205.26 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-3-propan-2-ylpyrazolo[3,4-d]pyridazin-7-amine is sourced from PubChem (CID 161483150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).