Chemical ID: 4837625

CN(C)C(=O)Nc1[nH]nnn1
Chemical ID:
4837625
Name [?]:
1,1-dimethyl-3-(1H-tetrazol-5-yl)urea
SMILES [?]:
CN(C)C(=O)Nc1[nH]nnn1
InChi [?]:
InChI=1/C4H8N6O/c1-10(2)4(11)5-3-6-8-9-7-3/h1-2H3,(H2,5,6,7,8,9,11)
InChi Info:
AuxInfo=1/1/N:1,3,7,4,6,8,11,9,10,2,5/E:(1,2)(6,7)(8,9)/rA:11nCNCCONCNNNN/rB:s1;s2;s2;d4;s4;s6;s7;s8;d9;d7s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C4H8N6O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:6.17382
Area:311.818
Solvation:-1.62163
Coulombic:-39.5018
Bond Count [?]
All:11
Single:8
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:156.146
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:-1.26
LogP (Chemaxon):-0.24

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Descriptor Annotations

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