1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine

C6H8N6S — CID 63150079

IUPAC1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine
SMILESCn1nnnc1NCc1nccs1
InChIInChI=1S/C6H8N6S/c1-12-6(9-10-11-12)8-4-5-7-2-3-13-5/h2-3H,4H2,1H3,(H,8,9,11)
InChIKeyFZMMXYJPCVQLGJ-UHFFFAOYSA-N
MW196.24 g/mol
LogP0.28
Rot. Bonds3

About 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine

1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine (PubChem CID 63150079) has the molecular formula C6H8N6S and a molecular weight of 196.24 g/mol. Its IUPAC name is 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine.

Molecular Properties

Compound Name1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine
PubChem CID63150079
Molecular FormulaC6H8N6S
Molecular Weight196.24 g/mol
Exact Mass196.05
IUPAC Name1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine
SMILESCn1nnnc1NCc1nccs1
InChIInChI=1S/C6H8N6S/c1-12-6(9-10-11-12)8-4-5-7-2-3-13-5/h2-3H,4H2,1H3,(H,8,9,11)
InChIKeyFZMMXYJPCVQLGJ-UHFFFAOYSA-N
XLogP0.28
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.24
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

3-(1-methyltetrazol-5-yl)-N-(1,3-thiazol-2-ylmethyl)aniline
CID 55248719
1-methyl-N-(1,3-thiazol-4-ylmethyl)tetrazol-5-amine
CID 63718090
2-N,3-N-bis(1,3-thiazol-2-ylmethyl)pyrazine-2,3-diamine
CID 86794222
1-methyl-N-(pyridin-3-ylmethyl)tetrazol-5-amine
CID 18801252
1,3-dimethyl-5-N-(1,3-thiazol-2-ylmethyl)pyrazole-4,5-diamine
CID 61285224
5,6-diethyl-N-(1,3-thiazol-2-ylmethyl)-1,2,4-triazin-3-amine
CID 105362504
N-[(3-methyltriazol-4-yl)methyl]-2-(1,3-thiazol-2-yl)ethanamine
CID 115682543
N-[[4-(2-aminoethyl)phenyl]methyl]-1-methyltetrazol-5-amine
CID 63150195
N-[(2-chlorophenyl)methyl]-1-methyltetrazol-5-amine
CID 4725595
5-ethyl-N-(1,3-thiazol-2-ylmethyl)-1,3,4-thiadiazol-2-amine
CID 103933936
4,6-dimethyl-N-(1,3-thiazol-2-ylmethyl)pyrimidin-2-amine
CID 61283291
N-[(2-methoxyphenyl)methyl]-1-methyltetrazol-5-amine
CID 4727584

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine?
The IUPAC name of 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine (CID 63150079) is 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine.
What is the SMILES notation for 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine?
The canonical SMILES for 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine is Cn1nnnc1NCc1nccs1.
What is the InChIKey of 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine?
The InChIKey is FZMMXYJPCVQLGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N6S/c1-12-6(9-10-11-12)8-4-5-7-2-3-13-5/h2-3H,4H2,1H3,(H,8,9,11).
What are the key properties of 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine?
1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine has a molecular weight of 196.24 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(1,3-thiazol-2-ylmethyl)tetrazol-5-amine is sourced from PubChem (CID 63150079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).