N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide

C24H24N2O2 — CID 166351351

IUPACN-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
SMILESCc1cccc(C)c1Oc1ccccc1NC(=O)c1cccc2c1NCCC2
InChIInChI=1S/C24H24N2O2/c1-16-8-5-9-17(2)23(16)28-21-14-4-3-13-20(21)26-24(27)19-12-6-10-18-11-7-15-25-22(18)19/h3-6,8-10,12-14,25H,7,11,15H2,1-2H3,(H,26,27)
InChIKeyCDAZCSXRHPLZDJ-UHFFFAOYSA-N
MW372.47 g/mol
LogP5.71
Rot. Bonds4

About N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide

N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide (PubChem CID 166351351) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
PubChem CID166351351
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC NameN-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide
SMILESCc1cccc(C)c1Oc1ccccc1NC(=O)c1cccc2c1NCCC2
InChIInChI=1S/C24H24N2O2/c1-16-8-5-9-17(2)23(16)28-21-14-4-3-13-20(21)26-24(27)19-12-6-10-18-11-7-15-25-22(18)19/h3-6,8-10,12-14,25H,7,11,15H2,1-2H3,(H,26,27)
InChIKeyCDAZCSXRHPLZDJ-UHFFFAOYSA-N
XLogP5.71
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.47
LogP ≤ 55.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethyl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide
CID 18071557
N-methyl-1,2,3,4-tetrahydroquinoline-8-carboxamide;hydrochloride
CID 146675579
N-(3-ethylpentan-3-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 65041181
N-butyl-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62213109
N-(2,3-dimethylbutyl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 64599539
N-[4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)-2-methylphenyl]-2,3-dihydro-1H-indole-7-carboxamide
CID 76846870
2-ethoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzamide
CID 16545688
N-(2-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-5-carboxamide
CID 104557860
4-propan-2-yl-N-(1,2,3,4-tetrahydroquinolin-8-yl)benzamide
CID 43823002
N-(1-methylpiperidin-4-yl)-1,2,3,4-tetrahydroquinoline-8-carboxamide
CID 62214552
3-hydroxy-2-methyl-N-(5,6,7,8-tetrahydronaphthalen-1-yl)benzamide
CID 82782191
N-propan-2-yl-2-(1,2,3,4-tetrahydroquinolin-8-yloxy)propanamide
CID 43117555

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The IUPAC name of N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide (CID 166351351) is N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide.
What is the SMILES notation for N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The canonical SMILES for N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide is Cc1cccc(C)c1Oc1ccccc1NC(=O)c1cccc2c1NCCC2.
What is the InChIKey of N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
The InChIKey is CDAZCSXRHPLZDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-16-8-5-9-17(2)23(16)28-21-14-4-3-13-20(21)26-24(27)19-12-6-10-18-11-7-15-25-22(18)19/h3-6,8-10,12-14,25H,7,11,15H2,1-2H3,(H,26,27).
What are the key properties of N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide?
N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide has a molecular weight of 372.47 g/mol, XLogP of 5.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylphenoxy)phenyl]-1,2,3,4-tetrahydroquinoline-8-carboxamide is sourced from PubChem (CID 166351351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).