2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide

C18H26N2O — CID 24698002

IUPAC2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide
SMILESCC1CCC(NC(=O)C2CC(C)Nc3ccccc32)CC1
InChIInChI=1S/C18H26N2O/c1-12-7-9-14(10-8-12)20-18(21)16-11-13(2)19-17-6-4-3-5-15(16)17/h3-6,12-14,16,19H,7-11H2,1-2H3,(H,20,21)
InChIKeyHOWVMHLEGTWQIY-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.67
Rot. Bonds2

About 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide

2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide (PubChem CID 24698002) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide
PubChem CID24698002
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide
SMILESCC1CCC(NC(=O)C2CC(C)Nc3ccccc32)CC1
InChIInChI=1S/C18H26N2O/c1-12-7-9-14(10-8-12)20-18(21)16-11-13(2)19-17-6-4-3-5-15(16)17/h3-6,12-14,16,19H,7-11H2,1-2H3,(H,20,21)
InChIKeyHOWVMHLEGTWQIY-UHFFFAOYSA-N
XLogP3.67
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 ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide?
The IUPAC name of 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide (CID 24698002) is 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide.
What is the SMILES notation for 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide?
The canonical SMILES for 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide is CC1CCC(NC(=O)C2CC(C)Nc3ccccc32)CC1.
What is the InChIKey of 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide?
The InChIKey is HOWVMHLEGTWQIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-12-7-9-14(10-8-12)20-18(21)16-11-13(2)19-17-6-4-3-5-15(16)17/h3-6,12-14,16,19H,7-11H2,1-2H3,(H,20,21).
What are the key properties of 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide?
2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 3.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(4-methylcyclohexyl)-1,2,3,4-tetrahydroquinoline-4-carboxamide is sourced from PubChem (CID 24698002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).