triazine;hydrochloride

C3H4ClN3 — CID 19089978

IUPACtriazine;hydrochloride
SMILESCl.c1cnnnc1
InChIInChI=1S/C3H3N3.ClH/c1-2-4-6-5-3-1;/h1-3H;1H
InChIKeyFDRPZJWMPZUHBN-UHFFFAOYSA-N
MW117.54 g/mol
LogP0.29
Rot. Bonds

About triazine;hydrochloride

triazine;hydrochloride (PubChem CID 19089978) has the molecular formula C3H4ClN3 and a molecular weight of 117.54 g/mol. Its IUPAC name is triazine;hydrochloride.

Molecular Properties

Compound Nametriazine;hydrochloride
PubChem CID19089978
Molecular FormulaC3H4ClN3
Molecular Weight117.54 g/mol
Exact Mass117.01
IUPAC Nametriazine;hydrochloride
SMILESCl.c1cnnnc1
InChIInChI=1S/C3H3N3.ClH/c1-2-4-6-5-3-1;/h1-3H;1H
InChIKeyFDRPZJWMPZUHBN-UHFFFAOYSA-N
XLogP0.29
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.54
LogP ≤ 50.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

CID 123047
CID 123047
CID 17804398
CID 17804398
CID 18318800
CID 18318800
CID 18348163
CID 18348163
CID 18357672
CID 18357672
CID 19796202
CID 19796202
CID 20030809
CID 20030809
CID 20037391
CID 20037391
CID 20343709
CID 20343709
CID 23191315
CID 23191315
CID 69879782
CID 69879782
CID 22718953
CID 22718953

Frequently Asked Questions

What is the IUPAC name of triazine;hydrochloride?
The IUPAC name of triazine;hydrochloride (CID 19089978) is triazine;hydrochloride.
What is the SMILES notation for triazine;hydrochloride?
The canonical SMILES for triazine;hydrochloride is Cl.c1cnnnc1.
What is the InChIKey of triazine;hydrochloride?
The InChIKey is FDRPZJWMPZUHBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.ClH/c1-2-4-6-5-3-1;/h1-3H;1H.
What are the key properties of triazine;hydrochloride?
triazine;hydrochloride has a molecular weight of 117.54 g/mol, XLogP of 0.29, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for triazine;hydrochloride is sourced from PubChem (CID 19089978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).