N,N-dimethyl-4-nitro-1H-pyrazole-3-carboxamide

N,N-dimethyl-4-nitro-1H-pyrazole-3-carboxamide

CAS: 1352200-35-1

Formula: C6H8N4O3

SMILES: CN(C)C(=O)C1=NNC=C1[N+]([O-])=O

IUPAC: N,N-dimethyl-4-nitro-1H-pyrazole-3-carboxamide

InChI: InChI=1S/C6H8N4O3/c1-9(2)6(11)5-4(10(12)13)3-7-8-5/h3H,1-2H3,(H,7,8)

Composition: C (39.13%), H (4.38%), N (30.42%), O (26.06%)

Molar Mass: 184.155

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	184.059640134
Formal Charge	0
FSP3	0.33
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PLYCMKTYHQBXOS-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.57
Topological Polar Surface Area	92.13
Polarizability	15.76
Ring Count	1
Rotatable Bond Count	2

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