N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine

C5H10N4 — CID 56828625

IUPACN-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine
SMILESCNCc1ncnn1C
InChIInChI=1S/C5H10N4/c1-6-3-5-7-4-8-9(5)2/h4,6H,3H2,1-2H3
InChIKeyXFRKAZBZVVTALF-UHFFFAOYSA-N
MW126.16 g/mol
LogP-0.47
Rot. Bonds2

About N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine

N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine (PubChem CID 56828625) has the molecular formula C5H10N4 and a molecular weight of 126.16 g/mol. Its IUPAC name is N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine
PubChem CID56828625
Molecular FormulaC5H10N4
Molecular Weight126.16 g/mol
Exact Mass126.09
IUPAC NameN-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine
SMILESCNCc1ncnn1C
InChIInChI=1S/C5H10N4/c1-6-3-5-7-4-8-9(5)2/h4,6H,3H2,1-2H3
InChIKeyXFRKAZBZVVTALF-UHFFFAOYSA-N
XLogP-0.47
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine 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

dimethyl-1H-1,2,4-triazol-3-amine
CID 307976
(4-methyl-4H-1,2,4-triazol-3-yl)methanamine
CID 21744036
methyl(((4-(propan-2-yl)-4H-1,2,4-triazol-3-yl)methyl))amine
CID 16763501
alpha,4-Dimethyl-4H-1,2,4-triazole-3-methanamine
CID 16766592
methyl[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]amine
CID 23005312
1-(1-Methyl-1H-1,2,4-triazol-5-yl)ethan-1-amine
CID 45791132
1,3-dimethyl-1H-1,2,4-triazol-5-amine
CID 307975
2-(3,5-Dimethyl-1H-1,2,4-triazol-1-yl)ethan-1-amine
CID 6492581
(1-methyl-1H-1,2,4-triazol-3-yl)methanamine hydrochloride
CID 18314526
(1-methyl-1H-1,2,4-triazol-5-yl)methanamine
CID 18330011
5H,6H,7H,8H-(1,2,4)triazolo(1,5-a)pyrazine
CID 18406919
(4-ethyl-4H-1,2,4-triazol-3-yl)methanamine
CID 24695936

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine (CID 56828625) is N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine is CNCc1ncnn1C.
What is the InChIKey of N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine?
The InChIKey is XFRKAZBZVVTALF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4/c1-6-3-5-7-4-8-9(5)2/h4,6H,3H2,1-2H3.
What are the key properties of N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine?
N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine has a molecular weight of 126.16 g/mol, XLogP of -0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methyl-1,2,4-triazol-3-yl)methanamine is sourced from PubChem (CID 56828625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).