2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine

C15H26N4 — CID 106550557

IUPAC2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine
SMILESCc1cnnc(N2CCCC(CNCC(C)C)C2)c1
InChIInChI=1S/C15H26N4/c1-12(2)8-16-10-14-5-4-6-19(11-14)15-7-13(3)9-17-18-15/h7,9,12,14,16H,4-6,8,10-11H2,1-3H3
InChIKeyHYVGVGPALQKDCZ-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.25
Rot. Bonds5

About 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine

2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine (PubChem CID 106550557) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine
PubChem CID106550557
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine
SMILESCc1cnnc(N2CCCC(CNCC(C)C)C2)c1
InChIInChI=1S/C15H26N4/c1-12(2)8-16-10-14-5-4-6-19(11-14)15-7-13(3)9-17-18-15/h7,9,12,14,16H,4-6,8,10-11H2,1-3H3
InChIKeyHYVGVGPALQKDCZ-UHFFFAOYSA-N
XLogP2.25
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine (CID 106550557) is 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine is Cc1cnnc(N2CCCC(CNCC(C)C)C2)c1.
What is the InChIKey of 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine?
The InChIKey is HYVGVGPALQKDCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-12(2)8-16-10-14-5-4-6-19(11-14)15-7-13(3)9-17-18-15/h7,9,12,14,16H,4-6,8,10-11H2,1-3H3.
What are the key properties of 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine?
2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 2.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(5-methylpyridazin-3-yl)piperidin-3-yl]methyl]propan-1-amine is sourced from PubChem (CID 106550557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).