N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium

C5H10N4V — CID 161276001

IUPACN,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium
SMILESCN(C)Cn1cncn1.[V]
InChIInChI=1S/C5H10N4.V/c1-8(2)5-9-4-6-3-7-9;/h3-4H,5H2,1-2H3;
InChIKeyVELHCIJNFYTUDT-UHFFFAOYSA-N
MW177.11 g/mol
LogP-0.21
Rot. Bonds2

About N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium

N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium (PubChem CID 161276001) has the molecular formula C5H10N4V and a molecular weight of 177.11 g/mol. Its IUPAC name is N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium.

Molecular Properties

Compound NameN,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium
PubChem CID161276001
Molecular FormulaC5H10N4V
Molecular Weight177.11 g/mol
Exact Mass177.03
IUPAC NameN,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium
SMILESCN(C)Cn1cncn1.[V]
InChIInChI=1S/C5H10N4.V/c1-8(2)5-9-4-6-3-7-9;/h3-4H,5H2,1-2H3;
InChIKeyVELHCIJNFYTUDT-UHFFFAOYSA-N
XLogP-0.21
TPSA33.95 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.11
LogP ≤ 5-0.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-octadecyl-N-(1,2,4-triazol-1-ylmethyl)octadecan-1-amine
CID 139658583
1,2,4-triazol-1-ylmethylphosphane
CID 67877171
1,2,4-triazol-1-ylmethylsilane
CID 123456022
2-[2-hydroxyethyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]ethanol
CID 162384997
2-[methyl-[2-(1,2,4-triazol-1-yl)ethyl]amino]acetonitrile
CID 156563626
N-methyl-N-[2-(1,2,4-triazol-1-yl)ethyl]carbamoyl chloride
CID 131847612
1-(2-fluoroethyl)-1,2,4-triazole
CID 18406854
2-(1,2,4-triazol-1-yl)ethanamine
CID 3039957
1-[(2S)-2-methylbutyl]-1,2,4-triazole
CID 89197135
2-(1,2,4-triazol-1-yl)-N-[2-(1,2,4-triazol-1-yl)ethyl]ethanamine
CID 50987387
N-(1,2,4-triazol-1-ylmethyl)-4-(2,4,4-trimethylpentan-2-yl)-N-[4-(2,4,4-trimethylpentan-2-yl)phenyl]aniline
CID 126566325
copper;tetrakis(1-ethyl-1,2,4-triazole);dinitrate
CID 139059520

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium?
The IUPAC name of N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium (CID 161276001) is N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium.
What is the SMILES notation for N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium?
The canonical SMILES for N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium is CN(C)Cn1cncn1.[V].
What is the InChIKey of N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium?
The InChIKey is VELHCIJNFYTUDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N4.V/c1-8(2)5-9-4-6-3-7-9;/h3-4H,5H2,1-2H3;.
What are the key properties of N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium?
N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium has a molecular weight of 177.11 g/mol, XLogP of -0.21, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1,2,4-triazol-1-yl)methanamine;vanadium is sourced from PubChem (CID 161276001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).