2-amino-1,3,8-triazaspiro[4.5]dec-1-en-4-one dihydrochloride

2-amino-1,3,8-triazaspiro[4.5]dec-1-en-4-one dihydrochloride

CAS: 1269106-47-9

Formula: C7H14Cl2N4O

SMILES: Cl.Cl.NC1=NC2(CCNCC2)C(=O)N1

IUPAC: 2-amino-1,3,8-triazaspiro[4.5]dec-1-en-4-one dihydrochloride

InChI: InChI=1S/C7H12N4O.2ClH/c8-6-10-5(12)7(11-6)1-3-9-4-2-7;;/h9H,1-4H2,(H3,8,10,11,12);2*1H

Composition: C (34.87%), H (5.85%), Cl (29.40%), N (23.24%), O (6.64%)

Molar Mass: 241.12

Atom Count: 28

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	240.0544665
Formal Charge	0
FSP3	0.71
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
InChIKey	WYTIOEQRJCJGHZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.42
Topological Polar Surface Area	79.51
Polarizability	16.81
Ring Count	2
Rotatable Bond Count	0

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