3-(2,4,8-trimethylquinolin-6-yl)propanamide

C15H18N2O — CID 82578358

IUPAC3-(2,4,8-trimethylquinolin-6-yl)propanamide
SMILESCc1cc(C)c2cc(CCC(N)=O)cc(C)c2n1
InChIInChI=1S/C15H18N2O/c1-9-6-11(3)17-15-10(2)7-12(8-13(9)15)4-5-14(16)18/h6-8H,4-5H2,1-3H3,(H2,16,18)
InChIKeyDNXNLZTVVOIIMT-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.58
Rot. Bonds3

About 3-(2,4,8-trimethylquinolin-6-yl)propanamide

3-(2,4,8-trimethylquinolin-6-yl)propanamide (PubChem CID 82578358) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 3-(2,4,8-trimethylquinolin-6-yl)propanamide.

Molecular Properties

Compound Name3-(2,4,8-trimethylquinolin-6-yl)propanamide
PubChem CID82578358
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name3-(2,4,8-trimethylquinolin-6-yl)propanamide
SMILESCc1cc(C)c2cc(CCC(N)=O)cc(C)c2n1
InChIInChI=1S/C15H18N2O/c1-9-6-11(3)17-15-10(2)7-12(8-13(9)15)4-5-14(16)18/h6-8H,4-5H2,1-3H3,(H2,16,18)
InChIKeyDNXNLZTVVOIIMT-UHFFFAOYSA-N
XLogP2.58
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,4,8-trimethylquinolin-6-yl)propanamide?
The IUPAC name of 3-(2,4,8-trimethylquinolin-6-yl)propanamide (CID 82578358) is 3-(2,4,8-trimethylquinolin-6-yl)propanamide.
What is the SMILES notation for 3-(2,4,8-trimethylquinolin-6-yl)propanamide?
The canonical SMILES for 3-(2,4,8-trimethylquinolin-6-yl)propanamide is Cc1cc(C)c2cc(CCC(N)=O)cc(C)c2n1.
What is the InChIKey of 3-(2,4,8-trimethylquinolin-6-yl)propanamide?
The InChIKey is DNXNLZTVVOIIMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-9-6-11(3)17-15-10(2)7-12(8-13(9)15)4-5-14(16)18/h6-8H,4-5H2,1-3H3,(H2,16,18).
What are the key properties of 3-(2,4,8-trimethylquinolin-6-yl)propanamide?
3-(2,4,8-trimethylquinolin-6-yl)propanamide has a molecular weight of 242.32 g/mol, XLogP of 2.58, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4,8-trimethylquinolin-6-yl)propanamide is sourced from PubChem (CID 82578358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).