N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide

C17H18N2O — CID 81423548

IUPACN-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide
SMILESO=C(NCc1cccc2c1NCCC2)c1ccccc1
InChIInChI=1S/C17H18N2O/c20-17(14-6-2-1-3-7-14)19-12-15-9-4-8-13-10-5-11-18-16(13)15/h1-4,6-9,18H,5,10-12H2,(H,19,20)
InChIKeyIJVDGZBFOLWJCB-UHFFFAOYSA-N
MW266.34 g/mol
LogP2.97
Rot. Bonds3

About N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide

N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide (PubChem CID 81423548) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide
PubChem CID81423548
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC NameN-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide
SMILESO=C(NCc1cccc2c1NCCC2)c1ccccc1
InChIInChI=1S/C17H18N2O/c20-17(14-6-2-1-3-7-14)19-12-15-9-4-8-13-10-5-11-18-16(13)15/h1-4,6-9,18H,5,10-12H2,(H,19,20)
InChIKeyIJVDGZBFOLWJCB-UHFFFAOYSA-N
XLogP2.97
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

methyl N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)carbamate
CID 81423829
2-methoxy-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)acetamide
CID 81423062
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)cycloheptanecarboxamide
CID 81424228
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)piperidine-1-carboxamide
CID 81423205
N,N-dimethyl-3-(1,2,3,4-tetrahydroquinolin-8-ylmethylamino)propanamide
CID 80649190
3-(1,2,3,4-tetrahydroquinolin-8-ylmethylamino)propanamide
CID 80648694
1-benzyl-3-(1,2,3,4-tetrahydroquinolin-8-yl)urea
CID 107653389
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)propan-2-amine
CID 80648504
3-(2,2-difluoroethoxy)-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)propanamide
CID 103206937
1-methyl-N-[2-(1,2,3,4-tetrahydroquinolin-8-yl)ethyl]pyrazole-4-carboxamide
CID 81424213
1,1-dioxo-N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)-2,3-dihydrothiophen-3-amine
CID 80650427
N-benzyl-2-(1,2,3,4-tetrahydroquinolin-8-yl)ethanamine
CID 125424059

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide?
The IUPAC name of N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide (CID 81423548) is N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide?
The canonical SMILES for N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide is O=C(NCc1cccc2c1NCCC2)c1ccccc1.
What is the InChIKey of N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide?
The InChIKey is IJVDGZBFOLWJCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c20-17(14-6-2-1-3-7-14)19-12-15-9-4-8-13-10-5-11-18-16(13)15/h1-4,6-9,18H,5,10-12H2,(H,19,20).
What are the key properties of N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide?
N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide has a molecular weight of 266.34 g/mol, XLogP of 2.97, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydroquinolin-8-ylmethyl)benzamide is sourced from PubChem (CID 81423548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).