7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide

C22H33N3O — CID 163526669

IUPAC7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide
SMILESCCN(CC)CCCC(C)CCC(=O)Nc1cc(C)cc2cccnc12
InChIInChI=1S/C22H33N3O/c1-5-25(6-2)14-8-9-17(3)11-12-21(26)24-20-16-18(4)15-19-10-7-13-23-22(19)20/h7,10,13,15-17H,5-6,8-9,11-12,14H2,1-4H3,(H,24,26)
InChIKeyHLCCEGWBWICBCD-UHFFFAOYSA-N
MW355.53 g/mol
LogP5.02
Rot. Bonds10

About 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide

7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide (PubChem CID 163526669) has the molecular formula C22H33N3O and a molecular weight of 355.53 g/mol. Its IUPAC name is 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide.

Molecular Properties

Compound Name7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide
PubChem CID163526669
Molecular FormulaC22H33N3O
Molecular Weight355.53 g/mol
Exact Mass355.26
IUPAC Name7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide
SMILESCCN(CC)CCCC(C)CCC(=O)Nc1cc(C)cc2cccnc12
InChIInChI=1S/C22H33N3O/c1-5-25(6-2)14-8-9-17(3)11-12-21(26)24-20-16-18(4)15-19-10-7-13-23-22(19)20/h7,10,13,15-17H,5-6,8-9,11-12,14H2,1-4H3,(H,24,26)
InChIKeyHLCCEGWBWICBCD-UHFFFAOYSA-N
XLogP5.02
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.53
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,1-N-diethyl-4-N-(6-methoxyquinolin-8-yl)pentane-1,4-diamine;urea
CID 21115016
N-(6-methylquinolin-8-yl)-2-phenoxyacetamide
CID 110715572
5-(3-cyanophenoxy)-N-(6-methylquinolin-8-yl)pentanamide
CID 75396943
2-heptan-2-yloxy-N-(6-methylquinolin-8-yl)benzamide
CID 164678677
5-[dimethyl(phenyl)silyl]-4-methyl-N-quinolin-8-ylpentanamide
CID 163364489
N-quinolin-8-ylundecanamide
CID 3567928
N-(6-chloroquinolin-8-yl)-5-hydroxypentanamide
CID 79199292
2,6-dimethoxy-N-(6-methylquinolin-8-yl)benzamide
CID 110715570
5-methyl-N-(6-methylquinolin-8-yl)pyrazine-2-carboxamide
CID 147349053
1-[(2S)-1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]-3-(6-methylquinolin-8-yl)urea
CID 99584345
4-amino-N-[2-oxo-2-(quinolin-8-ylamino)ethyl]pentanamide;dihydrochloride
CID 120565209
(2S)-N-(6-methylquinolin-8-yl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide
CID 92612554

Frequently Asked Questions

What is the IUPAC name of 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide?
The IUPAC name of 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide (CID 163526669) is 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide.
What is the SMILES notation for 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide?
The canonical SMILES for 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide is CCN(CC)CCCC(C)CCC(=O)Nc1cc(C)cc2cccnc12.
What is the InChIKey of 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide?
The InChIKey is HLCCEGWBWICBCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H33N3O/c1-5-25(6-2)14-8-9-17(3)11-12-21(26)24-20-16-18(4)15-19-10-7-13-23-22(19)20/h7,10,13,15-17H,5-6,8-9,11-12,14H2,1-4H3,(H,24,26).
What are the key properties of 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide?
7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide has a molecular weight of 355.53 g/mol, XLogP of 5.02, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(diethylamino)-4-methyl-N-(6-methylquinolin-8-yl)heptanamide is sourced from PubChem (CID 163526669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).