4-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine dihydrochloride

4-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine dihydrochloride

CAS: 1221724-59-9

Formula: C8H16Cl2N4

SMILES: Cl.Cl.CC1=NC(=NN1)C1CCNCC1

IUPAC: 4-(5-methyl-1H-1,2,4-triazol-3-yl)piperidine dihydrochloride

InChI: InChI=1S/C8H14N4.2ClH/c1-6-10-8(12-11-6)7-2-4-9-5-3-7;;/h7,9H,2-5H2,1H3,(H,10,11,12);2*1H

Composition: C (40.18%), H (6.74%), Cl (29.65%), N (23.43%)

Molar Mass: 239.14

Atom Count: 30

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	238.0752019
Formal Charge	0
FSP3	0.75
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	NRKZSTHLHDSZLM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.42
Topological Polar Surface Area	53.6
Polarizability	17.95
Ring Count	2
Rotatable Bond Count	1

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