N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine

C11H21N5 — CID 80508976

IUPACN'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine
SMILESCN(C)CCCN(C)c1nnccc1CN
InChIInChI=1S/C11H21N5/c1-15(2)7-4-8-16(3)11-10(9-12)5-6-13-14-11/h5-6H,4,7-9,12H2,1-3H3
InChIKeyUUIZKCOSORVYGM-UHFFFAOYSA-N
MW223.32 g/mol
LogP0.32
Rot. Bonds6

About N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine

N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine (PubChem CID 80508976) has the molecular formula C11H21N5 and a molecular weight of 223.32 g/mol. Its IUPAC name is N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine
PubChem CID80508976
Molecular FormulaC11H21N5
Molecular Weight223.32 g/mol
Exact Mass223.18
IUPAC NameN'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine
SMILESCN(C)CCCN(C)c1nnccc1CN
InChIInChI=1S/C11H21N5/c1-15(2)7-4-8-16(3)11-10(9-12)5-6-13-14-11/h5-6H,4,7-9,12H2,1-3H3
InChIKeyUUIZKCOSORVYGM-UHFFFAOYSA-N
XLogP0.32
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-(aminomethyl)-N-methyl-N-(3-phenylpropyl)pyridazin-3-amine
CID 80507508
4-(aminomethyl)-N-methyl-N-(3-methylbutyl)pyridazin-3-amine
CID 80509129
4-(aminomethyl)-N-methyl-N-(3,3,3-trifluoropropyl)pyridazin-3-amine
CID 80509001
4-(aminomethyl)-N-methyl-N-(2-methylpropyl)pyridazin-3-amine
CID 80507390
4-(aminomethyl)-N-(cyclopropylmethyl)-N-methylpyridazin-3-amine
CID 80507556
4-(aminomethyl)-N-methyl-N-[(4-methylphenyl)methyl]pyridazin-3-amine
CID 80507368
4-(aminomethyl)-N-butyl-N-ethylpyridazin-3-amine
CID 80507569
4-(aminomethyl)-N-methyl-N-[(2-methylphenyl)methyl]pyridazin-3-amine
CID 80507438
4-(aminomethyl)-N-methyl-N-(pyridin-2-ylmethyl)pyridazin-3-amine
CID 80507638
4-(aminomethyl)-N-[(4-bromophenyl)methyl]-N-methylpyridazin-3-amine
CID 80508839
4-(aminomethyl)-N-methyl-N-(pyridin-3-ylmethyl)pyridazin-3-amine
CID 80507616
4-(aminomethyl)-N-[(4-methoxyphenyl)methyl]-N-methylpyridazin-3-amine
CID 80508911

Frequently Asked Questions

What is the IUPAC name of N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine?
The IUPAC name of N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine (CID 80508976) is N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine.
What is the SMILES notation for N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine?
The canonical SMILES for N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine is CN(C)CCCN(C)c1nnccc1CN.
What is the InChIKey of N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine?
The InChIKey is UUIZKCOSORVYGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5/c1-15(2)7-4-8-16(3)11-10(9-12)5-6-13-14-11/h5-6H,4,7-9,12H2,1-3H3.
What are the key properties of N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine?
N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine has a molecular weight of 223.32 g/mol, XLogP of 0.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(aminomethyl)pyridazin-3-yl]-N,N,N'-trimethylpropane-1,3-diamine is sourced from PubChem (CID 80508976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).