4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine

C12H20N4 — CID 80508921

IUPAC4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine
SMILESCCc1nnc(NC2CC2)c(CN)c1CC
InChIInChI=1S/C12H20N4/c1-3-9-10(7-13)12(14-8-5-6-8)16-15-11(9)4-2/h8H,3-7,13H2,1-2H3,(H,14,16)
InChIKeyBTPLPLGHJPMQSV-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.63
Rot. Bonds5

About 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine

4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine (PubChem CID 80508921) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine
PubChem CID80508921
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine
SMILESCCc1nnc(NC2CC2)c(CN)c1CC
InChIInChI=1S/C12H20N4/c1-3-9-10(7-13)12(14-8-5-6-8)16-15-11(9)4-2/h8H,3-7,13H2,1-2H3,(H,14,16)
InChIKeyBTPLPLGHJPMQSV-UHFFFAOYSA-N
XLogP1.63
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(aminomethyl)-N-(cyclopropylmethyl)-5,6-diethyl-N-methylpyridazin-3-amine
CID 80507578
3-[(3,3-dimethylcyclopentyl)amino]-5,6-diethylpyridazine-4-carboxylic acid
CID 114541269
3-[(1,1-dioxothiolan-3-yl)amino]-5,6-diethylpyridazine-4-carboxylic acid
CID 80517540
[3-(2,5-dimethylpiperidin-1-yl)-5,6-diethylpyridazin-4-yl]methanamine
CID 80509097
[5,6-diethyl-3-(oxan-4-ylmethoxy)pyridazin-4-yl]methanamine
CID 80507868
4-(aminomethyl)-5,6-diethyl-N-methyl-N-(4-methylcyclohexyl)pyridazin-3-amine
CID 80508147
N-cyclopropyl-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80932555
8-[4-(aminomethyl)-5,6-diethylpyridazin-3-yl]-8-azabicyclo[3.2.1]octan-3-ol
CID 80508232
4-(aminomethyl)-5,6-diethyl-N-methyl-N-(oxolan-3-yl)pyridazin-3-amine
CID 82732973
[5,6-diethyl-3-[(2-methylpropan-2-yl)oxy]pyridazin-4-yl]methanamine
CID 80507981
3-[(2-amino-1-cyclopentylethyl)amino]-5,6-diethylpyridazine-4-carbonitrile
CID 106738206
5,6-diethyl-3-(piperidin-3-ylamino)pyridazine-4-carbonitrile
CID 80515330

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine?
The IUPAC name of 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine (CID 80508921) is 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine.
What is the SMILES notation for 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine?
The canonical SMILES for 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine is CCc1nnc(NC2CC2)c(CN)c1CC.
What is the InChIKey of 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine?
The InChIKey is BTPLPLGHJPMQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-3-9-10(7-13)12(14-8-5-6-8)16-15-11(9)4-2/h8H,3-7,13H2,1-2H3,(H,14,16).
What are the key properties of 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine?
4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.63, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-cyclopropyl-5,6-diethylpyridazin-3-amine is sourced from PubChem (CID 80508921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).