Chemical ID: 7211450

Cc1c(cn(n1)C)C(=O)N(C)Cc2c(nn(c2C)C)C
Chemical ID:
7211450
Name [?]:
N,1,3-trimethyl-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazole-4-carboxamide
SMILES [?]:
Cc1c(cn(n1)C)C(=O)N(C)Cc2c(nn(c2C)C)C
InChi [?]:
InChI=1/C14H21N5O/c1-9-12(11(3)19(6)16-9)7-17(4)14(20)13-8-18(5)15-10(13)2/h8H,7H2,1-6H3
InChi Info:
AuxInfo=1/0/N:20,1,18,11,7,19,12,4,14,2,17,13,3,8,6,15,10,5,16,9/rA:20nCCCCNNCCONCCCCNNCCCC/rB:s1;s2;d3;s4;d2s5;s5;s3;d8;s8;s10;s10;s12;s13;d14;s15;d13s16;s17;s16;s14;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H21N5O
All Atoms:41
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.01941
Area:467.243
Solvation:-3.66166
Coulombic:-22.7193
Bond Count [?]
All:21
Single:16
Double:5
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:275.35
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:0.79
LogP (Chemaxon):-0.13

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Descriptor Annotations

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