N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine

C10H13N5 — CID 3826763

IUPACN,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine
SMILESCN(C)Cc1nnnn1-c1ccccc1
InChIInChI=1S/C10H13N5/c1-14(2)8-10-11-12-13-15(10)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKeyNURBHWJLXRGKTK-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.72
Rot. Bonds3

About N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine

N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine (PubChem CID 3826763) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine
PubChem CID3826763
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC NameN,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine
SMILESCN(C)Cc1nnnn1-c1ccccc1
InChIInChI=1S/C10H13N5/c1-14(2)8-10-11-12-13-15(10)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
InChIKeyNURBHWJLXRGKTK-UHFFFAOYSA-N
XLogP0.72
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 50.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-Phenyl-1H-tetrazole
CID 138477
5-Methyl-1-phenyl-1H-tetrazole
CID 95204
N-methyl-1-phenyl-1H-1,2,3,4-tetrazol-5-amine
CID 285158
3-methyl-4-phenyl-4H-1,2,4-triazole
CID 12216908
1-[[1-(3-Methylbutyl)tetrazol-5-yl]methyl]-4-phenylpiperazine
CID 1448648
1-(4-Fluorophenyl)-4-[[1-(3-methylbutyl)tetrazol-5-yl]methyl]piperazine
CID 1448649
1-(4-fluorophenyl)-4-(1-phenyl-1H-1,2,3,4-tetrazol-5-yl)piperazine
CID 1448756
4-[(1-phenyl-1H-tetraazol-5-yl)methyl]morpholine
CID 3029444
1-[1-(4-Chloro-phenyl)-1H-tetrazol-5-ylmethyl]-4-methyl-piperidine
CID 3167930
1-Phenyl-5-[(1-phenyltetrazol-5-yl)methyl]tetrazole
CID 3090521
(1-((1-Phenyl-1H-1,2,4-triazol-5-yl)methyl)-2-pyrrolidinylidene)cyanamide
CID 3074553
(1-Phenyltetrazol-5-yl)methanamine
CID 2968625

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine (CID 3826763) is N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine is CN(C)Cc1nnnn1-c1ccccc1.
What is the InChIKey of N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine?
The InChIKey is NURBHWJLXRGKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-14(2)8-10-11-12-13-15(10)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine?
N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine has a molecular weight of 203.25 g/mol, XLogP of 0.72, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(1-phenyltetrazol-5-yl)methanamine is sourced from PubChem (CID 3826763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).