N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide

C18H26N2O — CID 65018541

IUPACN-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide
SMILESO=C(Nc1cccc2c1CCCN2)C1CCCCCCC1
InChIInChI=1S/C18H26N2O/c21-18(14-8-4-2-1-3-5-9-14)20-17-12-6-11-16-15(17)10-7-13-19-16/h6,11-12,14,19H,1-5,7-10,13H2,(H,20,21)
InChIKeySIYNSVZIYYUNCN-UHFFFAOYSA-N
MW286.42 g/mol
LogP4.34
Rot. Bonds2

About N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide

N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide (PubChem CID 65018541) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide
PubChem CID65018541
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide
SMILESO=C(Nc1cccc2c1CCCN2)C1CCCCCCC1
InChIInChI=1S/C18H26N2O/c21-18(14-8-4-2-1-3-5-9-14)20-17-12-6-11-16-15(17)10-7-13-19-16/h6,11-12,14,19H,1-5,7-10,13H2,(H,20,21)
InChIKeySIYNSVZIYYUNCN-UHFFFAOYSA-N
XLogP4.34
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-cycloheptyl-N-(1,2,3,4-tetrahydroquinolin-5-yl)acetamide
CID 114457423
N-(1,2,3,4-tetrahydroquinolin-5-yl)piperidine-1-carboxamide
CID 79155006
N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
CID 837694
1-propyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea
CID 28786606
1,1-diethyl-3-(1,2,3,4-tetrahydroquinolin-5-yl)urea
CID 79161957
3-(oxolan-2-yl)-N-(1,2,3,4-tetrahydroquinolin-5-yl)propanamide
CID 65154594
N-(1,2,3,4-tetrahydroquinolin-6-yl)cycloheptanecarboxamide
CID 62633858
cyclopropyl(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 116610491
N-(2,3-dichlorophenyl)cyclohexanecarboxamide
CID 836509
(2R,3R)-N-(2,3-dihydro-1H-indol-4-yl)-2-phenyloxolane-3-carboxamide
CID 138030908
N-quinolin-8-ylcyclohexanecarboxamide
CID 835933
2-(cycloheptanecarbonylamino)benzoic acid
CID 55091870

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide?
The IUPAC name of N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide (CID 65018541) is N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide?
The canonical SMILES for N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide is O=C(Nc1cccc2c1CCCN2)C1CCCCCCC1.
What is the InChIKey of N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide?
The InChIKey is SIYNSVZIYYUNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c21-18(14-8-4-2-1-3-5-9-14)20-17-12-6-11-16-15(17)10-7-13-19-16/h6,11-12,14,19H,1-5,7-10,13H2,(H,20,21).
What are the key properties of N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide?
N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide has a molecular weight of 286.42 g/mol, XLogP of 4.34, 2 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-5-yl)cyclooctanecarboxamide is sourced from PubChem (CID 65018541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).