2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide

C18H22N2O3S — CID 18163395

IUPAC2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)N(CC)Cc1cccs1
InChIInChI=1S/C18H22N2O3S/c1-3-20(13-14-8-7-11-24-14)17(21)12-19-18(22)15-9-5-6-10-16(15)23-4-2/h5-11H,3-4,12-13H2,1-2H3,(H,19,22)
InChIKeyNENGMDZMJJXMPJ-UHFFFAOYSA-N
MW346.45 g/mol
LogP2.93
Rot. Bonds8

About 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide

2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide (PubChem CID 18163395) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide
PubChem CID18163395
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC Name2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)N(CC)Cc1cccs1
InChIInChI=1S/C18H22N2O3S/c1-3-20(13-14-8-7-11-24-14)17(21)12-19-18(22)15-9-5-6-10-16(15)23-4-2/h5-11H,3-4,12-13H2,1-2H3,(H,19,22)
InChIKeyNENGMDZMJJXMPJ-UHFFFAOYSA-N
XLogP2.93
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[2-[ethyl-[(4-methoxyphenyl)methyl]amino]-2-oxoethyl]benzamide
CID 55593757
3,4-diethoxy-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801031
ethyl 2-[(2-ethoxybenzoyl)amino]acetate
CID 4056517
N-ethyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 78801832
N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide
CID 35341413
2-(cyclopropylmethylamino)-N-ethyl-N-(thiophen-2-ylmethyl)acetamide;hydrochloride
CID 119689999
2-iodo-N-[2-oxo-2-[prop-2-enyl(thiophen-2-ylmethyl)amino]ethyl]benzamide
CID 31330561
N-ethyl-4-oxo-4-thiophen-2-yl-N-(thiophen-2-ylmethyl)butanamide
CID 78801765
N-ethyl-2-(2-methoxyethoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 103602479
N-ethyl-2-(4-fluorophenoxy)-N-(thiophen-2-ylmethyl)acetamide
CID 67512148
2-[[2-[(2-ethoxybenzoyl)amino]acetyl]amino]acetic acid
CID 43387480
N-(thiophen-2-ylmethyl)-2-[3-[2-(thiophen-2-ylmethylcarbamoyl)phenoxy]-2,2-bis[[2-(thiophen-2-ylmethylcarbamoyl)phenoxy]methyl]propoxy]benzamide
CID 102205335

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide (CID 18163395) is 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide is CCOc1ccccc1C(=O)NCC(=O)N(CC)Cc1cccs1.
What is the InChIKey of 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide?
The InChIKey is NENGMDZMJJXMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-3-20(13-14-8-7-11-24-14)17(21)12-19-18(22)15-9-5-6-10-16(15)23-4-2/h5-11H,3-4,12-13H2,1-2H3,(H,19,22).
What are the key properties of 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide?
2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide has a molecular weight of 346.45 g/mol, XLogP of 2.93, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 18163395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).