2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one

C21H24N2O2 — CID 20931380

IUPAC2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one
SMILESCCN(Cc1ccc(OC)cc1)Cc1cc(=O)c2cc(C)ccc2[nH]1
InChIInChI=1S/C21H24N2O2/c1-4-23(13-16-6-8-18(25-3)9-7-16)14-17-12-21(24)19-11-15(2)5-10-20(19)22-17/h5-12H,4,13-14H2,1-3H3,(H,22,24)
InChIKeyYZLMZOLCDXGWQE-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.87
Rot. Bonds6

About 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one

2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one (PubChem CID 20931380) has the molecular formula C21H24N2O2 and a molecular weight of 336.44 g/mol. Its IUPAC name is 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one.

Molecular Properties

Compound Name2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one
PubChem CID20931380
Molecular FormulaC21H24N2O2
Molecular Weight336.44 g/mol
Exact Mass336.18
IUPAC Name2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one
SMILESCCN(Cc1ccc(OC)cc1)Cc1cc(=O)c2cc(C)ccc2[nH]1
InChIInChI=1S/C21H24N2O2/c1-4-23(13-16-6-8-18(25-3)9-7-16)14-17-12-21(24)19-11-15(2)5-10-20(19)22-17/h5-12H,4,13-14H2,1-3H3,(H,22,24)
InChIKeyYZLMZOLCDXGWQE-UHFFFAOYSA-N
XLogP3.87
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(4-ethoxyphenyl)methyl-propylamino]methyl]-6-methyl-1H-quinolin-4-one
CID 20931387
2-[[benzyl-[(4-methylphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one
CID 20931351
2-[[ethyl-[[(2S)-oxan-2-yl]methyl]amino]methyl]-6-methyl-1H-quinolin-4-one
CID 97155530
2-(6-methoxy-4-oxo-1H-quinolin-2-yl)acetamide
CID 25174598
3-[[ethyl-[(6-methoxy-2-methyl-4-oxo-1H-quinolin-3-yl)methyl]amino]methyl]-6-methoxy-2-methyl-1H-quinolin-4-one
CID 608539
2-[[ethyl-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]amino]methyl]-6-fluoro-1H-quinolin-4-one
CID 72881161
2-[[benzyl-[(4-ethoxyphenyl)methyl]amino]methyl]-6,8-dimethyl-1H-quinolin-4-one
CID 20931394
3-[(4-methoxyphenyl)methyl]-6-methyl-1H-quinazoline-2,4-dione
CID 22449593
2-methoxy-7-methyl-10H-acridin-9-one
CID 24773760
N-ethyl-N-[(4-methoxyphenyl)methyl]-5-methyl-1H-indazole-3-carboxamide
CID 78866013
N,N-diethylethanamine;1-methoxy-4-methylbenzene
CID 90934747
2-[[(4-chlorophenyl)methyl-(2-methylpropyl)amino]methyl]-6-fluoro-1H-quinolin-4-one
CID 20931329

Frequently Asked Questions

What is the IUPAC name of 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one?
The IUPAC name of 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one (CID 20931380) is 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one.
What is the SMILES notation for 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one?
The canonical SMILES for 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one is CCN(Cc1ccc(OC)cc1)Cc1cc(=O)c2cc(C)ccc2[nH]1.
What is the InChIKey of 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one?
The InChIKey is YZLMZOLCDXGWQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O2/c1-4-23(13-16-6-8-18(25-3)9-7-16)14-17-12-21(24)19-11-15(2)5-10-20(19)22-17/h5-12H,4,13-14H2,1-3H3,(H,22,24).
What are the key properties of 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one?
2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one has a molecular weight of 336.44 g/mol, XLogP of 3.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[ethyl-[(4-methoxyphenyl)methyl]amino]methyl]-6-methyl-1H-quinolin-4-one is sourced from PubChem (CID 20931380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).