N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine

C12H19N3 — CID 105157145

IUPACN-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
SMILESCCNC(c1cc(C)nnc1C)C1CC1
InChIInChI=1S/C12H19N3/c1-4-13-12(10-5-6-10)11-7-8(2)14-15-9(11)3/h7,10,12-13H,4-6H2,1-3H3
InChIKeyUHWXDLPNCUZRJU-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.15
Rot. Bonds4

About N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine

N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine (PubChem CID 105157145) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
PubChem CID105157145
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC NameN-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
SMILESCCNC(c1cc(C)nnc1C)C1CC1
InChIInChI=1S/C12H19N3/c1-4-13-12(10-5-6-10)11-7-8(2)14-15-9(11)3/h7,10,12-13H,4-6H2,1-3H3
InChIKeyUHWXDLPNCUZRJU-UHFFFAOYSA-N
XLogP2.15
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclohexyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105079539
N-[(3,6-dimethylpyridazin-4-yl)-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 105155357
2-cyclopropyl-1-(3,6-dimethylpyridazin-4-yl)-N-ethylethanamine
CID 105152783
N-[cyclohexyl-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105079704
N-[(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methyl]propan-1-amine
CID 105156216
N-[cyclopropyl-(2-methyl-3-pyridinyl)methyl]ethanamine
CID 105157241
1-(3,6-dimethylpyridazin-4-yl)-1-(2-ethylcyclohexyl)-N-methylmethanamine
CID 105151150
N-[(3-ethyl-6-methylpyridazin-4-yl)-(oxan-3-yl)methyl]ethanamine
CID 107139181
N-[(2-ethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105151189
N-[cyclopropyl-(2-fluoro-5-methylphenyl)methyl]ethanamine
CID 62791719
N-[(3,6-dimethylpyridazin-4-yl)-phenylmethyl]ethanamine
CID 105083698
1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 105153848

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine?
The IUPAC name of N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine (CID 105157145) is N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine?
The canonical SMILES for N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine is CCNC(c1cc(C)nnc1C)C1CC1.
What is the InChIKey of N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine?
The InChIKey is UHWXDLPNCUZRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-4-13-12(10-5-6-10)11-7-8(2)14-15-9(11)3/h7,10,12-13H,4-6H2,1-3H3.
What are the key properties of N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine?
N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine has a molecular weight of 205.30 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine is sourced from PubChem (CID 105157145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).