Chemical ID: 4984657

c1c(c(=N)[nH][nH]1)C(=O)N
Chemical ID:
4984657
Name [?]:
3-imino-1,2-dihydropyrazole-4-carboxamide
SMILES [?]:
c1c(c(=N)[nH][nH]1)C(=O)N
InChi [?]:
InChI=1/C4H6N4O/c5-3-2(4(6)9)1-7-8-3/h1H,(H2,6,9)(H3,5,7,8)
InChi Info:
AuxInfo=1/1/N:1,2,3,7,4,9,6,5,8/rA:9nCCCNNNCON/rB:d1;s2;w3;s3;s1s5;s2;d7;s7;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C4H6N4O
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:3.76395
Area:269.278
Solvation:-2.968
Coulombic:-52.3925
Bond Count [?]
All:9
Single:6
Double:3
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:126.117
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:-0.43
LogP (Chemaxon):-1.12

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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