N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide

C15H18N2O2 — CID 947723

IUPACN-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
SMILESCCN(Cc1cc2cc(C)ccc2[nH]c1=O)C(C)=O
InChIInChI=1S/C15H18N2O2/c1-4-17(11(3)18)9-13-8-12-7-10(2)5-6-14(12)16-15(13)19/h5-8H,4,9H2,1-3H3,(H,16,19)
InChIKeyNSMNTITZZGIKBD-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.20
Rot. Bonds3

About N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide

N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide (PubChem CID 947723) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide.

Molecular Properties

Compound NameN-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
PubChem CID947723
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
SMILESCCN(Cc1cc2cc(C)ccc2[nH]c1=O)C(C)=O
InChIInChI=1S/C15H18N2O2/c1-4-17(11(3)18)9-13-8-12-7-10(2)5-6-14(12)16-15(13)19/h5-8H,4,9H2,1-3H3,(H,16,19)
InChIKeyNSMNTITZZGIKBD-UHFFFAOYSA-N
XLogP2.20
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The IUPAC name of N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide (CID 947723) is N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide.
What is the SMILES notation for N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The canonical SMILES for N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide is CCN(Cc1cc2cc(C)ccc2[nH]c1=O)C(C)=O.
What is the InChIKey of N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
The InChIKey is NSMNTITZZGIKBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-4-17(11(3)18)9-13-8-12-7-10(2)5-6-14(12)16-15(13)19/h5-8H,4,9H2,1-3H3,(H,16,19).
What are the key properties of N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide?
N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide has a molecular weight of 258.32 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide is sourced from PubChem (CID 947723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).