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

C18H28N2O — CID 65447430

IUPACN-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1cccc2c1CCCN2
InChIInChI=1S/C18H28N2O/c1-2-3-4-5-6-7-13-18(21)20-17-12-8-11-16-15(17)10-9-14-19-16/h8,11-12,19H,2-7,9-10,13-14H2,1H3,(H,20,21)
InChIKeyISPNIUUHULQJBP-UHFFFAOYSA-N
MW288.43 g/mol
LogP4.73
Rot. Bonds8

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

N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide (PubChem CID 65447430) has the molecular formula C18H28N2O and a molecular weight of 288.43 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide
PubChem CID65447430
Molecular FormulaC18H28N2O
Molecular Weight288.43 g/mol
Exact Mass288.22
IUPAC NameN-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide
SMILESCCCCCCCCC(=O)Nc1cccc2c1CCCN2
InChIInChI=1S/C18H28N2O/c1-2-3-4-5-6-7-13-18(21)20-17-12-8-11-16-15(17)10-9-14-19-16/h8,11-12,19H,2-7,9-10,13-14H2,1H3,(H,20,21)
InChIKeyISPNIUUHULQJBP-UHFFFAOYSA-N
XLogP4.73
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.43
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

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
2-cycloheptyl-N-(1,2,3,4-tetrahydroquinolin-5-yl)acetamide
CID 114457423
N-(2,3-dimethylphenyl)dodecanamide
CID 4198682
N-(5,6,7,8-tetrahydronaphthalen-1-yl)butanamide
CID 652088
N-naphthalen-1-yldodecanamide
CID 588517
N-(1,2,3,4-tetrahydroquinolin-5-yl)cyclooctanecarboxamide
CID 65018541
N-(3-hydroxy-2-methylphenyl)decanamide
CID 65426726
N-heptan-2-yl-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 62849365
N-(2-ethylphenyl)undecanamide
CID 5078439
N-(2-fluorophenyl)hexanamide
CID 3481165
N-(2-ethylphenyl)heptanamide
CID 4582103

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide?
The IUPAC name of N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide (CID 65447430) is N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide?
The canonical SMILES for N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide is CCCCCCCCC(=O)Nc1cccc2c1CCCN2.
What is the InChIKey of N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide?
The InChIKey is ISPNIUUHULQJBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-2-3-4-5-6-7-13-18(21)20-17-12-8-11-16-15(17)10-9-14-19-16/h8,11-12,19H,2-7,9-10,13-14H2,1H3,(H,20,21).
What are the key properties of N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide?
N-(1,2,3,4-tetrahydroquinolin-5-yl)nonanamide has a molecular weight of 288.43 g/mol, XLogP of 4.73, 8 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)nonanamide is sourced from PubChem (CID 65447430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).