2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline

C11H15N5 — CID 68880752

IUPAC2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline
SMILESCc1cccc(NCc2nnn(C)n2)c1C
InChIInChI=1S/C11H15N5/c1-8-5-4-6-10(9(8)2)12-7-11-13-15-16(3)14-11/h4-6,12H,7H2,1-3H3
InChIKeyVCBHZUZUFMUZKP-UHFFFAOYSA-N
MW217.28 g/mol
LogP1.44
Rot. Bonds3

About 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline

2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline (PubChem CID 68880752) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline.

Molecular Properties

Compound Name2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline
PubChem CID68880752
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline
SMILESCc1cccc(NCc2nnn(C)n2)c1C
InChIInChI=1S/C11H15N5/c1-8-5-4-6-10(9(8)2)12-7-11-13-15-16(3)14-11/h4-6,12H,7H2,1-3H3
InChIKeyVCBHZUZUFMUZKP-UHFFFAOYSA-N
XLogP1.44
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline 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

1,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]pyrazol-4-amine
CID 107042771
5-[(2,3-dimethylphenoxy)methyl]-2-methyltetrazole
CID 107055284
2,4-dichloro-N-[(2-methyltetrazol-5-yl)methyl]aniline
CID 107042005
N-[(4-fluorophenyl)methyl]-2,3-dimethylaniline
CID 40632168
1-(2,3-dimethylphenyl)-2-(2-methyltetrazol-5-yl)ethanone
CID 107063250
2,3-dimethyl-N-[(1-propan-2-ylpyrazol-3-yl)methyl]aniline
CID 64773599
1-(2,3-dimethylphenyl)-N-ethyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107064894
3-ethyl-1-methyl-N-[(2-methyltetrazol-5-yl)methyl]pyrazol-4-amine
CID 107462626
N-(1H-imidazol-5-ylmethyl)-2,3-dimethylaniline
CID 13178310
2,3-dimethyl-N-[(5-methyl-1H-pyrazol-4-yl)methyl]aniline
CID 43663563
2-[(2,3-dimethylanilino)methyl]phenol
CID 3236047
2,3-dimethyl-N-[(4-trimethylsilylphenyl)methyl]aniline
CID 103437518

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline?
The IUPAC name of 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline (CID 68880752) is 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline.
What is the SMILES notation for 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline?
The canonical SMILES for 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline is Cc1cccc(NCc2nnn(C)n2)c1C.
What is the InChIKey of 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline?
The InChIKey is VCBHZUZUFMUZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8-5-4-6-10(9(8)2)12-7-11-13-15-16(3)14-11/h4-6,12H,7H2,1-3H3.
What are the key properties of 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline?
2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline has a molecular weight of 217.28 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-N-[(2-methyltetrazol-5-yl)methyl]aniline is sourced from PubChem (CID 68880752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).