N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide

C19H22N2O — CID 24691130

IUPACN-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
SMILESCCc1cccc(C)c1NC(=O)C1CCc2ccccc2N1
InChIInChI=1S/C19H22N2O/c1-3-14-9-6-7-13(2)18(14)21-19(22)17-12-11-15-8-4-5-10-16(15)20-17/h4-10,17,20H,3,11-12H2,1-2H3,(H,21,22)
InChIKeyQVDJFZFOGXTJCI-UHFFFAOYSA-N
MW294.40 g/mol
LogP3.92
Rot. Bonds3

About N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide

N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide (PubChem CID 24691130) has the molecular formula C19H22N2O and a molecular weight of 294.40 g/mol. Its IUPAC name is N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
PubChem CID24691130
Molecular FormulaC19H22N2O
Molecular Weight294.40 g/mol
Exact Mass294.17
IUPAC NameN-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
SMILESCCc1cccc(C)c1NC(=O)C1CCc2ccccc2N1
InChIInChI=1S/C19H22N2O/c1-3-14-9-6-7-13(2)18(14)21-19(22)17-12-11-15-8-4-5-10-16(15)20-17/h4-10,17,20H,3,11-12H2,1-2H3,(H,21,22)
InChIKeyQVDJFZFOGXTJCI-UHFFFAOYSA-N
XLogP3.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 43185137
N-(2-ethyl-6-methylphenyl)azepane-2-carboxamide
CID 64562791
N-(2-ethyl-6-methylphenyl)-2-hydroxycyclopentane-1-carboxamide
CID 110015386
N-(2-fluorophenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 24690959
N-(4-ethylcyclohexyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 61468172
N-(5-methylhexan-2-yl)-1,2,3,4-tetrahydroquinoline-2-carboxamide
CID 63926506
N-(2-ethyl-6-methylphenyl)-4-(4-formylpiperazine-1-carbonyl)cyclohexane-1-carboxamide
CID 109147639
N,N'-bis(2-ethyl-6-methylphenyl)oxamide
CID 3725747
(2R)-N-(2-ethyl-6-methylphenyl)oxolane-2-carboxamide
CID 887643
3-amino-N-(2-ethyl-6-methylphenyl)cyclopentane-1-carboxamide
CID 66032656
N-(2-ethyl-6-methylphenyl)-1-(2-phenylacetyl)piperidine-4-carboxamide
CID 113006744
N-(2-ethyl-6-methylphenyl)-1-(4-methylbenzoyl)piperidine-4-carboxamide
CID 113006739

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
The IUPAC name of N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide (CID 24691130) is N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide.
What is the SMILES notation for N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
The canonical SMILES for N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide is CCc1cccc(C)c1NC(=O)C1CCc2ccccc2N1.
What is the InChIKey of N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
The InChIKey is QVDJFZFOGXTJCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O/c1-3-14-9-6-7-13(2)18(14)21-19(22)17-12-11-15-8-4-5-10-16(15)20-17/h4-10,17,20H,3,11-12H2,1-2H3,(H,21,22).
What are the key properties of N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide?
N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide has a molecular weight of 294.40 g/mol, XLogP of 3.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-6-methylphenyl)-1,2,3,4-tetrahydroquinoline-2-carboxamide is sourced from PubChem (CID 24691130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).