6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine

C14H18N4S — CID 62279754

IUPAC6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine
SMILESCN(Cc1ccsc1)c1ccc(CNC2CC2)nn1
InChIInChI=1S/C14H18N4S/c1-18(9-11-6-7-19-10-11)14-5-4-13(16-17-14)8-15-12-2-3-12/h4-7,10,12,15H,2-3,8-9H2,1H3
InChIKeyLKIKBRBFBGUKNX-UHFFFAOYSA-N
MW274.39 g/mol
LogP2.43
Rot. Bonds6

About 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine

6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine (PubChem CID 62279754) has the molecular formula C14H18N4S and a molecular weight of 274.39 g/mol. Its IUPAC name is 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine
PubChem CID62279754
Molecular FormulaC14H18N4S
Molecular Weight274.39 g/mol
Exact Mass274.13
IUPAC Name6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine
SMILESCN(Cc1ccsc1)c1ccc(CNC2CC2)nn1
InChIInChI=1S/C14H18N4S/c1-18(9-11-6-7-19-10-11)14-5-4-13(16-17-14)8-15-12-2-3-12/h4-7,10,12,15H,2-3,8-9H2,1H3
InChIKeyLKIKBRBFBGUKNX-UHFFFAOYSA-N
XLogP2.43
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine
CID 107379171
N-methyl-6-(propylaminomethyl)-N-(thiophen-3-ylmethyl)pyridazin-3-amine
CID 62279753
6-[(cyclopropylamino)methyl]-N-methyl-N-[(1-methylimidazol-2-yl)methyl]pyridazin-3-amine
CID 63025331
5-[(cyclopropylamino)methyl]-N-methyl-4-propyl-N-(thiophen-3-ylmethyl)-1,3-thiazol-2-amine
CID 62767283
6-[(cyclopropylamino)methyl]-N-methyl-N-(oxan-2-ylmethyl)pyridazin-3-amine
CID 62281484
5-(ethylaminomethyl)-N-methyl-N-(thiophen-3-ylmethyl)pyridin-2-amine
CID 55054778
6-[(cyclopropylamino)methyl]-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyridazin-3-amine
CID 79311011
N-methyl-6-(methylaminomethyl)-N-(pyridin-4-ylmethyl)pyridazin-3-amine
CID 62283462
N-cyclopropyl-6-[(cyclopropylamino)methyl]-N-(thiophen-2-ylmethyl)pyridazin-3-amine
CID 62287480
4-propan-2-yl-N-(thiophen-3-ylmethyl)cyclohexan-1-amine
CID 63247711
N-[[3-bromo-4-[[methyl(thiophen-3-ylmethyl)amino]methyl]phenyl]methyl]cyclopropanamine
CID 102769676
N-[(4-bromophenyl)methyl]-5-[(cyclopropylamino)methyl]-N-methylpyridin-2-amine
CID 62287672

Frequently Asked Questions

What is the IUPAC name of 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine?
The IUPAC name of 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine (CID 62279754) is 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine?
The canonical SMILES for 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine is CN(Cc1ccsc1)c1ccc(CNC2CC2)nn1.
What is the InChIKey of 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine?
The InChIKey is LKIKBRBFBGUKNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4S/c1-18(9-11-6-7-19-10-11)14-5-4-13(16-17-14)8-15-12-2-3-12/h4-7,10,12,15H,2-3,8-9H2,1H3.
What are the key properties of 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine?
6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine has a molecular weight of 274.39 g/mol, XLogP of 2.43, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 62279754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).