1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine

C7H11N7 — CID 62743229

IUPAC1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine
SMILESCc1[nH]cnc1CNCc1nn[nH]n1
InChIInChI=1S/C7H11N7/c1-5-6(10-4-9-5)2-8-3-7-11-13-14-12-7/h4,8H,2-3H2,1H3,(H,9,10)(H,11,12,13,14)
InChIKeyIZTSXMSVJBVDNM-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.48
Rot. Bonds4

About 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine

1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine (PubChem CID 62743229) has the molecular formula C7H11N7 and a molecular weight of 193.21 g/mol. Its IUPAC name is 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine.

Molecular Properties

Compound Name1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine
PubChem CID62743229
Molecular FormulaC7H11N7
Molecular Weight193.21 g/mol
Exact Mass193.11
IUPAC Name1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine
SMILESCc1[nH]cnc1CNCc1nn[nH]n1
InChIInChI=1S/C7H11N7/c1-5-6(10-4-9-5)2-8-3-7-11-13-14-12-7/h4,8H,2-3H2,1H3,(H,9,10)(H,11,12,13,14)
InChIKeyIZTSXMSVJBVDNM-UHFFFAOYSA-N
XLogP-0.48
TPSA95.17 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5,5'-(1h-Imidazole-4,5-diyl)bis(1h-tetrazole)
CID 136803971
N-pentyl-5-[3-(trifluoromethyl)-1H-1,2,4-triazol-5-yl]-1H-imidazol-4-amine
CID 135984694
3-[3-(2,2-difluoroethyl)-5-methylimidazol-4-yl]-5-methyl-1H-1,2,4-triazole
CID 166698057
3-methyl-5-(4-methyl-1H-imidazol-5-yl)-1-(2,2,2-trifluoroethyl)-1H-1,2,4-triazole
CID 136237787
N-ethyl-N-[(4-methyl-1H-imidazol-5-yl)methyl]-2-pyrrolidin-1-ylethanamine
CID 50956167
1-[(2-ethyl-4-methyl-1H-imidazol-5-yl)methyl]-4-[2-(1H-1,2,4-triazol-1-yl)ethyl]piperazine
CID 50969252
N-methyl-1-(4-methyl-1H-imidazol-5-yl)-N-[(4-propyl-4H-1,2,4-triazol-3-yl)methyl]methanamine
CID 50978613
N,N-bis[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-N-propylamine
CID 12146731
N-(5-methyl-4-imidazolylmethyl)ethylenediamine
CID 20557710
2-methyl-1-[(5-methyl-1H-imidazol-4-yl)methyl]guanidine
CID 20701192
5-methyl-4,6-dihydro-1H-pyrrolo[3,4-d]imidazole
CID 54262321
5-(azidomethyl)-4-methyl-1H-imidazole
CID 57066865

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine?
The IUPAC name of 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine (CID 62743229) is 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine.
What is the SMILES notation for 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine?
The canonical SMILES for 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine is Cc1[nH]cnc1CNCc1nn[nH]n1.
What is the InChIKey of 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine?
The InChIKey is IZTSXMSVJBVDNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N7/c1-5-6(10-4-9-5)2-8-3-7-11-13-14-12-7/h4,8H,2-3H2,1H3,(H,9,10)(H,11,12,13,14).
What are the key properties of 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine?
1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine has a molecular weight of 193.21 g/mol, XLogP of -0.48, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-1H-imidazol-4-yl)-N-(2H-tetrazol-5-ylmethyl)methanamine is sourced from PubChem (CID 62743229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).