N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide

C15H20N2O2 — CID 63012221

IUPACN-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCCN2)C1CCCOC1
InChIInChI=1S/C15H20N2O2/c18-15(12-4-2-8-19-10-12)17-13-5-6-14-11(9-13)3-1-7-16-14/h5-6,9,12,16H,1-4,7-8,10H2,(H,17,18)
InChIKeyVAEFFUAIVHFSSB-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.41
Rot. Bonds2

About N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide

N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide (PubChem CID 63012221) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide
PubChem CID63012221
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC NameN-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide
SMILESO=C(Nc1ccc2c(c1)CCCN2)C1CCCOC1
InChIInChI=1S/C15H20N2O2/c18-15(12-4-2-8-19-10-12)17-13-5-6-14-11(9-13)3-1-7-16-14/h5-6,9,12,16H,1-4,7-8,10H2,(H,17,18)
InChIKeyVAEFFUAIVHFSSB-UHFFFAOYSA-N
XLogP2.41
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1,2,3,4-tetrahydroquinolin-6-yl)oxolane-3-carboxamide
CID 55138702
N-(1,2,3,4-tetrahydroquinolin-6-yl)cycloheptanecarboxamide
CID 62633858
N-(1,2,3,4-tetrahydroquinolin-6-yl)cyclopent-3-ene-1-carboxamide
CID 64767021
N-(2,3-dihydro-1H-indol-5-yl)cyclobutanecarboxamide
CID 63252649
N-(3-fluoro-4-hydroxyphenyl)oxane-3-carboxamide
CID 64780687
N-(1,2,3,4-tetrahydroquinolin-6-yl)thiolane-2-carboxamide;hydrochloride
CID 119547205
2-oxo-N-(1,2,3,4-tetrahydroquinolin-6-yl)-1,3-thiazolidine-4-carboxamide
CID 63283396
N-(6-bromonaphthalen-2-yl)oxane-3-carboxamide
CID 81004002
(2R)-N-(1,2,3,4-tetrahydroquinolin-7-yl)oxolane-2-carboxamide
CID 104856288
3-cyclopentyl-N-(1,2,3,4-tetrahydroquinolin-6-yl)propanamide
CID 62632415
N-(3-aminophenyl)oxane-3-carboxamide
CID 63011823
N-(2,3-dihydro-1H-indol-5-yl)bicyclo[4.1.0]heptane-7-carboxamide
CID 81479241

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide?
The IUPAC name of N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide (CID 63012221) is N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide?
The canonical SMILES for N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide is O=C(Nc1ccc2c(c1)CCCN2)C1CCCOC1.
What is the InChIKey of N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide?
The InChIKey is VAEFFUAIVHFSSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c18-15(12-4-2-8-19-10-12)17-13-5-6-14-11(9-13)3-1-7-16-14/h5-6,9,12,16H,1-4,7-8,10H2,(H,17,18).
What are the key properties of N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide?
N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide has a molecular weight of 260.34 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydroquinolin-6-yl)oxane-3-carboxamide is sourced from PubChem (CID 63012221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).