Chemical ID: 6857550

CCOC(=O)c1c[nH+]c2c(cc(cc2c1NCCCCCO)C)C
Chemical ID:
6857550
Name [?]:
ethyl 4-(5-hydroxypentylamino)-6,8-dimethyl-1H-quinoline-3-carboxylate
SMILES [?]:
CCOC(=O)c1c[nH+]c2c(cc(cc2c1NCCCCCO)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C19H27N2O3+
All Atoms:51
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:-19.9916
Area:577.295
Solvation:-34.4239
Coulombic:-38.2474
Bond Count [?]
All:25
Single:19
Double:6
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:331.429
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.59
LogP (Chemaxon):3.64

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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