2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide

C18H20N2O — CID 18071557

IUPAC2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide
SMILESCc1ccc(C)c(C(=O)Nc2cccc3c2NCCC3)c1
InChIInChI=1S/C18H20N2O/c1-12-8-9-13(2)15(11-12)18(21)20-16-7-3-5-14-6-4-10-19-17(14)16/h3,5,7-9,11,19H,4,6,10H2,1-2H3,(H,20,21)
InChIKeyBUQNEVJYTDRNCS-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.91
Rot. Bonds2

About 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide

2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide (PubChem CID 18071557) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide.

Molecular Properties

Compound Name2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide
PubChem CID18071557
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide
SMILESCc1ccc(C)c(C(=O)Nc2cccc3c2NCCC3)c1
InChIInChI=1S/C18H20N2O/c1-12-8-9-13(2)15(11-12)18(21)20-16-7-3-5-14-6-4-10-19-17(14)16/h3,5,7-9,11,19H,4,6,10H2,1-2H3,(H,20,21)
InChIKeyBUQNEVJYTDRNCS-UHFFFAOYSA-N
XLogP3.91
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide;hydrochloride
CID 119547274
4-propan-2-yl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide
CID 43823002
N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 166351351
2,5-dimethyl-N-(2-methylphenyl)benzamide
CID 925354
N-(3-bromo-2-methylphenyl)-2,5-dimethylbenzamide
CID 113230260
N-(2-acetamido-5-methylphenyl)-2,3-dihydro-1H-indene-4-carboxamide
CID 126795816
N-(2-chlorophenyl)-2,5-dimethylbenzamide
CID 925340
2,4-dimethyl-N-(1,2,3,4-tetrahydroisoquinolin-5-yl)benzamide
CID 43808455
N-(2-bromo-5-methylphenyl)-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 82747600
N-methyl-1,2,3,4-tetrahydroquinoline-8-carboxamide;hydrochloride
CID 146675579
2,5-dimethyl-N-(3-methylphenyl)benzamide
CID 925357
N-(2-chloro-4-methylphenyl)-5,6,7,8-tetrahydronaphthalene-1-carboxamide
CID 97455745

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide?
The IUPAC name of 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide (CID 18071557) is 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide.
What is the SMILES notation for 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide?
The canonical SMILES for 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide is Cc1ccc(C)c(C(=O)Nc2cccc3c2NCCC3)c1.
What is the InChIKey of 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide?
The InChIKey is BUQNEVJYTDRNCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-12-8-9-13(2)15(11-12)18(21)20-16-7-3-5-14-6-4-10-19-17(14)16/h3,5,7-9,11,19H,4,6,10H2,1-2H3,(H,20,21).
What are the key properties of 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide?
2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide has a molecular weight of 280.37 g/mol, XLogP of 3.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide is sourced from PubChem (CID 18071557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).