N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine

C11H18N4 — CID 104670235

IUPACN-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine
SMILESCN(CCNC1CC1)Cc1ccnnc1
InChIInChI=1S/C11H18N4/c1-15(7-6-12-11-2-3-11)9-10-4-5-13-14-8-10/h4-5,8,11-12H,2-3,6-7,9H2,1H3
InChIKeyJJKLUVSDBHPJBD-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.66
Rot. Bonds6

About N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine

N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine (PubChem CID 104670235) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine
PubChem CID104670235
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC NameN-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine
SMILESCN(CCNC1CC1)Cc1ccnnc1
InChIInChI=1S/C11H18N4/c1-15(7-6-12-11-2-3-11)9-10-4-5-13-14-8-10/h4-5,8,11-12H,2-3,6-7,9H2,1H3
InChIKeyJJKLUVSDBHPJBD-UHFFFAOYSA-N
XLogP0.66
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N'-methyl-N-(3-methylcyclohexyl)-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine
CID 62560432
N'-[(4-bromophenyl)methyl]-N'-methyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 63503276
N-cyclohexyl-N'-methyl-N'-[(4-methylphenyl)methyl]ethane-1,2-diamine
CID 62573288
N'-benzyl-N'-methyl-N-(thietan-3-yl)ethane-1,2-diamine
CID 131036276
N-cycloheptyl-N'-[(4-methoxyphenyl)methyl]-N'-methylethane-1,2-diamine
CID 62575486
N-cyclopropyl-N'-[(2,4-difluorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 62195867
N'-[(2-bromo-5-fluorophenyl)methyl]-N-cyclopropyl-N'-methylethane-1,2-diamine
CID 113409156
N-cyclopropyl-N'-methyl-N'-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 60843550
N-cyclopropyl-N'-[2-(4-ethylphenyl)ethyl]-N'-methylethane-1,2-diamine
CID 115207125
N-cyclopropyl-N'-[(2,5-dichlorophenyl)methyl]-N'-methylethane-1,2-diamine
CID 65317346
N-cyclopropyl-N'-methyl-N'-(naphthalen-1-ylmethyl)ethane-1,2-diamine
CID 55002950
N'-benzyl-N'-methyl-N-(4-methylcyclohexyl)propane-1,3-diamine
CID 29287205

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine (CID 104670235) is N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine is CN(CCNC1CC1)Cc1ccnnc1.
What is the InChIKey of N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine?
The InChIKey is JJKLUVSDBHPJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-15(7-6-12-11-2-3-11)9-10-4-5-13-14-8-10/h4-5,8,11-12H,2-3,6-7,9H2,1H3.
What are the key properties of N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine?
N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine has a molecular weight of 206.29 g/mol, XLogP of 0.66, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-methyl-N'-(pyridazin-4-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 104670235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).