2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide

C20H24N2O — CID 3103991

IUPAC2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide
SMILESCC1CC(N(C(=O)C(C)C)c2ccccc2)c2ccccc2N1
InChIInChI=1S/C20H24N2O/c1-14(2)20(23)22(16-9-5-4-6-10-16)19-13-15(3)21-18-12-8-7-11-17(18)19/h4-12,14-15,19,21H,13H2,1-3H3
InChIKeyKLNRFEANOBVSAV-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.62
Rot. Bonds3

About 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide

2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide (PubChem CID 3103991) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide
PubChem CID3103991
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide
SMILESCC1CC(N(C(=O)C(C)C)c2ccccc2)c2ccccc2N1
InChIInChI=1S/C20H24N2O/c1-14(2)20(23)22(16-9-5-4-6-10-16)19-13-15(3)21-18-12-8-7-11-17(18)19/h4-12,14-15,19,21H,13H2,1-3H3
InChIKeyKLNRFEANOBVSAV-UHFFFAOYSA-N
XLogP4.62
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide?
The IUPAC name of 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide (CID 3103991) is 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide?
The canonical SMILES for 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide is CC1CC(N(C(=O)C(C)C)c2ccccc2)c2ccccc2N1.
What is the InChIKey of 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide?
The InChIKey is KLNRFEANOBVSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c1-14(2)20(23)22(16-9-5-4-6-10-16)19-13-15(3)21-18-12-8-7-11-17(18)19/h4-12,14-15,19,21H,13H2,1-3H3.
What are the key properties of 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide?
2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide has a molecular weight of 308.43 g/mol, XLogP of 4.62, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylpropanamide is sourced from PubChem (CID 3103991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).