N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine

C13H17N3O — CID 105146876

IUPACN-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine
SMILESCCNC(c1ccco1)c1cc(C)nnc1C
InChIInChI=1S/C13H17N3O/c1-4-14-13(12-6-5-7-17-12)11-8-9(2)15-16-10(11)3/h5-8,13-14H,4H2,1-3H3
InChIKeyDSVNUKDRYZWBRY-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.39
Rot. Bonds4

About N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine

N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine (PubChem CID 105146876) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine
PubChem CID105146876
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC NameN-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine
SMILESCCNC(c1ccco1)c1cc(C)nnc1C
InChIInChI=1S/C13H17N3O/c1-4-14-13(12-6-5-7-17-12)11-8-9(2)15-16-10(11)3/h5-8,13-14H,4H2,1-3H3
InChIKeyDSVNUKDRYZWBRY-UHFFFAOYSA-N
XLogP2.39
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[(3,6-dimethylpyridazin-4-yl)-phenylmethyl]ethanamine
CID 105083698
N-[(2,6-dimethyl-4-pyridinyl)-(furan-2-yl)methyl]ethanamine
CID 107503948
N-[(2,4-dimethylphenyl)-(furan-2-yl)methyl]ethanamine
CID 43489925
N-[(3,6-dimethylpyridazin-4-yl)-pyridin-3-ylmethyl]ethanamine
CID 105098171
N-[(5-chloro-2-methylphenyl)-(furan-2-yl)methyl]ethanamine
CID 82883059
N-[(2-fluoro-3-methylphenyl)-(furan-2-yl)methyl]ethanamine
CID 81478017
N-[(2,5-dichlorophenyl)-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105142190
N-[furan-2-yl(pyrimidin-5-yl)methyl]ethanamine
CID 62715603
5-bromo-6-[ethylamino(furan-2-yl)methyl]-1,3-dihydrobenzimidazol-2-one
CID 62373407
N-[(2-chloro-4,5-dimethoxyphenyl)-(furan-2-yl)methyl]ethanamine
CID 43492710
N-[(3,6-dimethylpyridazin-4-yl)-thiophen-2-ylmethyl]propan-1-amine
CID 105100685
N-[furan-2-yl-(3,4,5-trifluorophenyl)methyl]ethanamine
CID 63185696

Frequently Asked Questions

What is the IUPAC name of N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine?
The IUPAC name of N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine (CID 105146876) is N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine.
What is the SMILES notation for N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine?
The canonical SMILES for N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine is CCNC(c1ccco1)c1cc(C)nnc1C.
What is the InChIKey of N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine?
The InChIKey is DSVNUKDRYZWBRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-4-14-13(12-6-5-7-17-12)11-8-9(2)15-16-10(11)3/h5-8,13-14H,4H2,1-3H3.
What are the key properties of N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine?
N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine has a molecular weight of 231.30 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,6-dimethylpyridazin-4-yl)-(furan-2-yl)methyl]ethanamine is sourced from PubChem (CID 105146876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).