2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine

C17H30N4 — CID 83044693

IUPAC2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine
SMILESCCCC1CCCCN1c1ccc(CNCC(C)C)nn1
InChIInChI=1S/C17H30N4/c1-4-7-16-8-5-6-11-21(16)17-10-9-15(19-20-17)13-18-12-14(2)3/h9-10,14,16,18H,4-8,11-13H2,1-3H3
InChIKeyPUBDHICJJFKSQG-UHFFFAOYSA-N
MW290.46 g/mol
LogP3.38
Rot. Bonds7

About 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine

2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine (PubChem CID 83044693) has the molecular formula C17H30N4 and a molecular weight of 290.46 g/mol. Its IUPAC name is 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine
PubChem CID83044693
Molecular FormulaC17H30N4
Molecular Weight290.46 g/mol
Exact Mass290.25
IUPAC Name2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine
SMILESCCCC1CCCCN1c1ccc(CNCC(C)C)nn1
InChIInChI=1S/C17H30N4/c1-4-7-16-8-5-6-11-21(16)17-10-9-15(19-20-17)13-18-12-14(2)3/h9-10,14,16,18H,4-8,11-13H2,1-3H3
InChIKeyPUBDHICJJFKSQG-UHFFFAOYSA-N
XLogP3.38
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.46
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-(2-ethylpiperidin-1-yl)-2-pyridinyl]methyl]-2-methylpropan-1-amine
CID 62279349
1-[6-(2-ethylpiperidin-1-yl)pyridazin-3-yl]-N-methylmethanamine
CID 62279015
N-[[6-(2-methylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine
CID 62285071
N-[[2-methyl-6-(2-propylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 83045595
[1-(6-propylpyridazin-3-yl)pyrrolidin-2-yl]methanamine
CID 116973022
2-[1-(6-ethylpyridazin-3-yl)piperidin-2-yl]acetic acid
CID 116972319
N-[[3-chloro-6-(2-propylpiperidin-1-yl)-2-pyridinyl]methyl]ethanamine
CID 83061614
N-[[2-methyl-6-(2-propylpiperidin-1-yl)-3-pyridinyl]methyl]cyclopropanamine
CID 83044523
6-(2-ethylpiperidin-1-yl)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 109111233
N-[(6-pyrrolidin-1-ylpyridazin-3-yl)methyl]propan-1-amine
CID 62285405
2-methyl-N-[[4-[(2-propylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]methyl]propan-1-amine
CID 83044336
2-propan-2-yloxy-6-(2-propylpiperidin-1-yl)pyridin-3-amine
CID 83052124

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine (CID 83044693) is 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine is CCCC1CCCCN1c1ccc(CNCC(C)C)nn1.
What is the InChIKey of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine?
The InChIKey is PUBDHICJJFKSQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-4-7-16-8-5-6-11-21(16)17-10-9-15(19-20-17)13-18-12-14(2)3/h9-10,14,16,18H,4-8,11-13H2,1-3H3.
What are the key properties of 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine?
2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine has a molecular weight of 290.46 g/mol, XLogP of 3.38, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[6-(2-propylpiperidin-1-yl)pyridazin-3-yl]methyl]propan-1-amine is sourced from PubChem (CID 83044693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).