6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine

C7H7ClN6 — CID 106194524

IUPAC6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine
SMILESClc1cccc(NCc2nn[nH]n2)n1
InChIInChI=1S/C7H7ClN6/c8-5-2-1-3-6(10-5)9-4-7-11-13-14-12-7/h1-3H,4H2,(H,9,10)(H,11,12,13,14)
InChIKeyNQXNYHRJACSVKT-UHFFFAOYSA-N
MW210.63 g/mol
LogP0.86
Rot. Bonds3

About 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine

6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine (PubChem CID 106194524) has the molecular formula C7H7ClN6 and a molecular weight of 210.63 g/mol. Its IUPAC name is 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine
PubChem CID106194524
Molecular FormulaC7H7ClN6
Molecular Weight210.63 g/mol
Exact Mass210.04
IUPAC Name6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine
SMILESClc1cccc(NCc2nn[nH]n2)n1
InChIInChI=1S/C7H7ClN6/c8-5-2-1-3-6(10-5)9-4-7-11-13-14-12-7/h1-3H,4H2,(H,9,10)(H,11,12,13,14)
InChIKeyNQXNYHRJACSVKT-UHFFFAOYSA-N
XLogP0.86
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.63
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-(2H-tetrazol-5-ylmethylamino)pyridine-2-carbonitrile
CID 64589167
6-chloro-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 53410285
[4-[[(6-chloro-2-pyridinyl)amino]methyl]phenyl]methanol
CID 106197039
6-chloro-N-[1-(2H-tetrazol-5-yl)ethyl]pyridin-2-amine
CID 106194451
4,6-dichloro-N-(2H-tetrazol-5-ylmethyl)-1,3,5-triazin-2-amine
CID 106194511
6-chloro-N-[(3-methoxyphenyl)methyl]pyridin-2-amine
CID 63587268
4-[[(6-chloro-2-pyridinyl)amino]methyl]-3H-1,3-thiazol-2-one
CID 106383027
2-chloro-N-(2H-tetrazol-5-ylmethyl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 114156673
2-chloro-6-(2H-tetrazol-5-ylmethylamino)benzonitrile
CID 62502767
6-chloro-N-(2-methylpropyl)pyridin-2-amine
CID 53410300
6-chloro-N-[(1-ethylpyrazol-4-yl)methyl]pyridin-2-amine
CID 102808181
6-chloro-N-[(2-methyltriazol-4-yl)methyl]pyridin-2-amine
CID 130747973

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine (CID 106194524) is 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine is Clc1cccc(NCc2nn[nH]n2)n1.
What is the InChIKey of 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine?
The InChIKey is NQXNYHRJACSVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN6/c8-5-2-1-3-6(10-5)9-4-7-11-13-14-12-7/h1-3H,4H2,(H,9,10)(H,11,12,13,14).
What are the key properties of 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine?
6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine has a molecular weight of 210.63 g/mol, XLogP of 0.86, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2H-tetrazol-5-ylmethyl)pyridin-2-amine is sourced from PubChem (CID 106194524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).