2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone

C16H19NO3 — CID 62037206

IUPAC2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone
SMILESCCN(CC(=O)c1ccccc1OC)Cc1ccco1
InChIInChI=1S/C16H19NO3/c1-3-17(11-13-7-6-10-20-13)12-15(18)14-8-4-5-9-16(14)19-2/h4-10H,3,11-12H2,1-2H3
InChIKeySJUTWPABCQEMCP-UHFFFAOYSA-N
MW273.33 g/mol
LogP2.99
Rot. Bonds7

About 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone

2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone (PubChem CID 62037206) has the molecular formula C16H19NO3 and a molecular weight of 273.33 g/mol. Its IUPAC name is 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone.

Molecular Properties

Compound Name2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone
PubChem CID62037206
Molecular FormulaC16H19NO3
Molecular Weight273.33 g/mol
Exact Mass273.14
IUPAC Name2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone
SMILESCCN(CC(=O)c1ccccc1OC)Cc1ccco1
InChIInChI=1S/C16H19NO3/c1-3-17(11-13-7-6-10-20-13)12-15(18)14-8-4-5-9-16(14)19-2/h4-10H,3,11-12H2,1-2H3
InChIKeySJUTWPABCQEMCP-UHFFFAOYSA-N
XLogP2.99
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[ethyl(furan-2-ylmethyl)amino]-1-phenylethanone
CID 62037006
1-(3-bromo-4-methoxyphenyl)-2-[ethyl(furan-2-ylmethyl)amino]ethanone
CID 62036819
1-(2,5-dibromothiophen-3-yl)-2-[ethyl(furan-2-ylmethyl)amino]ethanone
CID 62037184
2-[ethyl(furan-2-ylmethyl)amino]-1-(4-ethylphenyl)ethanone
CID 62036997
1-[ethyl(furan-2-ylmethyl)amino]-3-methylbutan-2-one
CID 79395471
1-[ethyl(furan-2-ylmethyl)amino]-3-phenylpropan-2-one
CID 62037011
2-[ethyl(furan-2-ylmethyl)amino]-1-(4-propylphenyl)ethanone
CID 62037203
N-[(2R)-butan-2-yl]-N-[2-[furan-2-ylmethyl(2-phenylethyl)amino]-2-oxoethyl]-2-methoxybenzamide
CID 93109724
2-[ethyl(furan-2-ylmethyl)amino]-1-(3-fluorophenyl)ethanone
CID 62037198
3-[ethyl(furan-2-ylmethyl)amino]-1-phenylpropan-1-one
CID 55094929
2-[cyclopropyl(ethyl)amino]-1-(2-methoxyphenyl)ethanone
CID 43794992
1,3-bis(2-methoxyphenyl)propane-1,3-dione
CID 15664665

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone?
The IUPAC name of 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone (CID 62037206) is 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone.
What is the SMILES notation for 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone?
The canonical SMILES for 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone is CCN(CC(=O)c1ccccc1OC)Cc1ccco1.
What is the InChIKey of 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone?
The InChIKey is SJUTWPABCQEMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3/c1-3-17(11-13-7-6-10-20-13)12-15(18)14-8-4-5-9-16(14)19-2/h4-10H,3,11-12H2,1-2H3.
What are the key properties of 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone?
2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone has a molecular weight of 273.33 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(furan-2-ylmethyl)amino]-1-(2-methoxyphenyl)ethanone is sourced from PubChem (CID 62037206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).