4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine

C7H7ClN6 — CID 170352602

IUPAC4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine
SMILESCn1nnc(Nc2cc(Cl)ccn2)n1
InChIInChI=1S/C7H7ClN6/c1-14-12-7(11-13-14)10-6-4-5(8)2-3-9-6/h2-4H,1H3,(H,9,10,12)
InChIKeyJKZWVWDAIRUSTE-UHFFFAOYSA-N
MW210.63 g/mol
LogP1.00
Rot. Bonds2

About 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine

4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine (PubChem CID 170352602) has the molecular formula C7H7ClN6 and a molecular weight of 210.63 g/mol. Its IUPAC name is 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine
PubChem CID170352602
Molecular FormulaC7H7ClN6
Molecular Weight210.63 g/mol
Exact Mass210.04
IUPAC Name4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine
SMILESCn1nnc(Nc2cc(Cl)ccn2)n1
InChIInChI=1S/C7H7ClN6/c1-14-12-7(11-13-14)10-6-4-5(8)2-3-9-6/h2-4H,1H3,(H,9,10,12)
InChIKeyJKZWVWDAIRUSTE-UHFFFAOYSA-N
XLogP1.00
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.63
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
The IUPAC name of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine (CID 170352602) is 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine.
What is the SMILES notation for 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
The canonical SMILES for 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine is Cn1nnc(Nc2cc(Cl)ccn2)n1.
What is the InChIKey of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
The InChIKey is JKZWVWDAIRUSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClN6/c1-14-12-7(11-13-14)10-6-4-5(8)2-3-9-6/h2-4H,1H3,(H,9,10,12).
What are the key properties of 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine?
4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine has a molecular weight of 210.63 g/mol, XLogP of 1.00, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-methyltetrazol-5-yl)pyridin-2-amine is sourced from PubChem (CID 170352602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).