N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine

C8H10N6 — CID 131070932

IUPACN-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine
SMILESCc1ncccc1CNc1nn[nH]n1
InChIInChI=1S/C8H10N6/c1-6-7(3-2-4-9-6)5-10-8-11-13-14-12-8/h2-4H,5H2,1H3,(H2,10,11,12,13,14)
InChIKeyDLINGGDJZBNBKR-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.52
Rot. Bonds3

About N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine

N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine (PubChem CID 131070932) has the molecular formula C8H10N6 and a molecular weight of 190.21 g/mol. Its IUPAC name is N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine.

Molecular Properties

Compound NameN-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine
PubChem CID131070932
Molecular FormulaC8H10N6
Molecular Weight190.21 g/mol
Exact Mass190.10
IUPAC NameN-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine
SMILESCc1ncccc1CNc1nn[nH]n1
InChIInChI=1S/C8H10N6/c1-6-7(3-2-4-9-6)5-10-8-11-13-14-12-8/h2-4H,5H2,1H3,(H2,10,11,12,13,14)
InChIKeyDLINGGDJZBNBKR-UHFFFAOYSA-N
XLogP0.52
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine?
The IUPAC name of N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine (CID 131070932) is N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine.
What is the SMILES notation for N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine?
The canonical SMILES for N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine is Cc1ncccc1CNc1nn[nH]n1.
What is the InChIKey of N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine?
The InChIKey is DLINGGDJZBNBKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N6/c1-6-7(3-2-4-9-6)5-10-8-11-13-14-12-8/h2-4H,5H2,1H3,(H2,10,11,12,13,14).
What are the key properties of N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine?
N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine has a molecular weight of 190.21 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methyl-3-pyridinyl)methyl]-2H-tetrazol-5-amine is sourced from PubChem (CID 131070932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).