Chemical ID: 5758109

CCC(C)(C#C)N
Chemical ID:
5758109
Name [?]:
3-methylpent-1-yn-3-amine
SMILES [?]:
CCC(C)(C#C)N
InChi [?]:
InChI=1/C6H11N/c1-4-6(3,7)5-2/h1H,5,7H2,2-3H3
InChi Info:
AuxInfo=1/0/N:6,1,4,5,2,3,7/rA:7cCCCCCCN/rB:s1;s2;s3;s3;t5;s3;/rC:;;;;;;;

Chemical Details

Atom Count
Formula:C6H11N
All Atoms:7
Heavy Atoms:7
Chiral Atoms:1
ZAP Information [?]
Total:5.81055
Area:260.036
Solvation:-0.690342
Coulombic:-15.1987
Bond Count [?]
All:6
Single:5
Double:0
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:97.1583
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:0.7
LogP (Chemaxon):0.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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