4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide

C16H19N7O — CID 133384331

IUPAC4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide
SMILESCCN(Cc1ccc(C(=O)N(C)C)cc1)c1ccc2nnnn2n1
InChIInChI=1S/C16H19N7O/c1-4-22(15-10-9-14-17-19-20-23(14)18-15)11-12-5-7-13(8-6-12)16(24)21(2)3/h5-10H,4,11H2,1-3H3
InChIKeyMZMDRBHKCUHHML-UHFFFAOYSA-N
MW325.38 g/mol
LogP1.25
Rot. Bonds5

About 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide

4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide (PubChem CID 133384331) has the molecular formula C16H19N7O and a molecular weight of 325.38 g/mol. Its IUPAC name is 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide
PubChem CID133384331
Molecular FormulaC16H19N7O
Molecular Weight325.38 g/mol
Exact Mass325.17
IUPAC Name4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide
SMILESCCN(Cc1ccc(C(=O)N(C)C)cc1)c1ccc2nnnn2n1
InChIInChI=1S/C16H19N7O/c1-4-22(15-10-9-14-17-19-20-23(14)18-15)11-12-5-7-13(8-6-12)16(24)21(2)3/h5-10H,4,11H2,1-3H3
InChIKeyMZMDRBHKCUHHML-UHFFFAOYSA-N
XLogP1.25
TPSA79.52 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.38
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide 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

4-[[(6-chloro-2-methylpyrimidin-4-yl)-ethylamino]methyl]-N,N-dimethylbenzamide
CID 133384313
N,N-dimethyl-4-(tetrazolo[1,5-b]pyridazin-6-ylamino)benzamide
CID 24650274
4-[(4-cyano-N-ethylanilino)methyl]-N,N-dimethylbenzamide
CID 133384325
4-[[ethyl(furo[3,2-c]pyridin-4-yl)amino]methyl]-N,N-dimethylbenzamide
CID 86805556
N-[2-(4-bromophenyl)ethyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
CID 133292138
N-[(6-methoxynaphthalen-2-yl)methyl]-N-methyltetrazolo[1,5-b]pyridazin-6-amine
CID 17452018
4-[[bis(2-hydroxyethyl)amino]methyl]-N,N-dimethylbenzamide
CID 111487813
N-methyl-N-[(3-propan-2-yloxyphenyl)methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 133417071
N-ethyl-N-methyl-4-(sulfanylmethyl)benzamide
CID 142914162
4-[[buta-2,3-dienoyl(ethyl)amino]methyl]-N,N-dimethylbenzamide
CID 167790546
4-[(4-amino-N-ethylanilino)methyl]benzamide
CID 63233885
N-(2-bromoethyl)-N-pentan-3-yltetrazolo[1,5-b]pyridazin-6-amine
CID 80680191

Frequently Asked Questions

What is the IUPAC name of 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide?
The IUPAC name of 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide (CID 133384331) is 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide.
What is the SMILES notation for 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide?
The canonical SMILES for 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide is CCN(Cc1ccc(C(=O)N(C)C)cc1)c1ccc2nnnn2n1.
What is the InChIKey of 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide?
The InChIKey is MZMDRBHKCUHHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N7O/c1-4-22(15-10-9-14-17-19-20-23(14)18-15)11-12-5-7-13(8-6-12)16(24)21(2)3/h5-10H,4,11H2,1-3H3.
What are the key properties of 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide?
4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide has a molecular weight of 325.38 g/mol, XLogP of 1.25, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[ethyl(tetrazolo[1,5-b]pyridazin-6-yl)amino]methyl]-N,N-dimethylbenzamide is sourced from PubChem (CID 133384331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).