1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine

C17H24N6 — CID 126917536

IUPAC1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
SMILESCN(CCc1ccnn1C)C1CN(c2ccc(C3CC3)nn2)C1
InChIInChI=1S/C17H24N6/c1-21(10-8-14-7-9-18-22(14)2)15-11-23(12-15)17-6-5-16(19-20-17)13-3-4-13/h5-7,9,13,15H,3-4,8,10-12H2,1-2H3
InChIKeyCRUBOGFRBPHOCP-UHFFFAOYSA-N
MW312.42 g/mol
LogP1.45
Rot. Bonds6

About 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine

1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine (PubChem CID 126917536) has the molecular formula C17H24N6 and a molecular weight of 312.42 g/mol. Its IUPAC name is 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine.

Molecular Properties

Compound Name1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
PubChem CID126917536
Molecular FormulaC17H24N6
Molecular Weight312.42 g/mol
Exact Mass312.21
IUPAC Name1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine
SMILESCN(CCc1ccnn1C)C1CN(c2ccc(C3CC3)nn2)C1
InChIInChI=1S/C17H24N6/c1-21(10-8-14-7-9-18-22(14)2)15-11-23(12-15)17-6-5-16(19-20-17)13-3-4-13/h5-7,9,13,15H,3-4,8,10-12H2,1-2H3
InChIKeyCRUBOGFRBPHOCP-UHFFFAOYSA-N
XLogP1.45
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine?
The IUPAC name of 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine (CID 126917536) is 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine.
What is the SMILES notation for 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine?
The canonical SMILES for 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine is CN(CCc1ccnn1C)C1CN(c2ccc(C3CC3)nn2)C1.
What is the InChIKey of 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine?
The InChIKey is CRUBOGFRBPHOCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6/c1-21(10-8-14-7-9-18-22(14)2)15-11-23(12-15)17-6-5-16(19-20-17)13-3-4-13/h5-7,9,13,15H,3-4,8,10-12H2,1-2H3.
What are the key properties of 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine?
1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine has a molecular weight of 312.42 g/mol, XLogP of 1.45, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-cyclopropylpyridazin-3-yl)-N-methyl-N-[2-(2-methylpyrazol-3-yl)ethyl]azetidin-3-amine is sourced from PubChem (CID 126917536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).