4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine

C15H27N5 — CID 63233240

IUPAC4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine
SMILESCc1nnc(N(C)CC2CCN(C)CC2)c(CN)c1C
InChIInChI=1S/C15H27N5/c1-11-12(2)17-18-15(14(11)9-16)20(4)10-13-5-7-19(3)8-6-13/h13H,5-10,16H2,1-4H3
InChIKeyCSXNGQLAOFHZNY-UHFFFAOYSA-N
MW277.42 g/mol
LogP1.33
Rot. Bonds4

About 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine

4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine (PubChem CID 63233240) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine
PubChem CID63233240
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine
SMILESCc1nnc(N(C)CC2CCN(C)CC2)c(CN)c1C
InChIInChI=1S/C15H27N5/c1-11-12(2)17-18-15(14(11)9-16)20(4)10-13-5-7-19(3)8-6-13/h13H,5-10,16H2,1-4H3
InChIKeyCSXNGQLAOFHZNY-UHFFFAOYSA-N
XLogP1.33
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-N,5,6-trimethyl-N-[(2-methylcyclopropyl)methyl]pyridazin-3-amine
CID 63878876
4-(aminomethyl)-N,1,3-trimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyrazol-5-amine
CID 63274020
3-[cyclopentylmethyl(methyl)amino]-5,6-dimethylpyridazine-4-carboxylic acid
CID 63657397
4-(aminomethyl)-N-(cyclopropylmethyl)-5,6-diethyl-N-methylpyridazin-3-amine
CID 80507578
1-[[4-(aminomethyl)-5,6-dimethylpyridazin-3-yl]-methylamino]-2-methylpropan-2-ol
CID 79384857
5-(aminomethyl)-N,3-dimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyridin-2-amine
CID 80636014
3-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]pyrazine-2-carbothioamide
CID 63234371
3-(chloromethyl)-N,4,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridin-2-amine
CID 63236337
4-(aminomethyl)-N,5,6-trimethyl-N-[(4-methylphenyl)methyl]pyridazin-3-amine
CID 61098823
3-chloro-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]pyrazin-2-amine
CID 63235390
N-methyl-1-(1-methylpiperidin-4-yl)-N-[(1-methylpiperidin-4-yl)methyl]methanamine
CID 169319670
1-ethyl-5-N,3-dimethyl-5-N-[(1-methylpiperidin-4-yl)methyl]pyrazole-4,5-diamine
CID 66011883

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine?
The IUPAC name of 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine (CID 63233240) is 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine.
What is the SMILES notation for 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine?
The canonical SMILES for 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine is Cc1nnc(N(C)CC2CCN(C)CC2)c(CN)c1C.
What is the InChIKey of 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine?
The InChIKey is CSXNGQLAOFHZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-11-12(2)17-18-15(14(11)9-16)20(4)10-13-5-7-19(3)8-6-13/h13H,5-10,16H2,1-4H3.
What are the key properties of 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine?
4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine has a molecular weight of 277.42 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N,5,6-trimethyl-N-[(1-methylpiperidin-4-yl)methyl]pyridazin-3-amine is sourced from PubChem (CID 63233240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).