ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate

C14H15NO2S — CID 91149975

IUPACethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate
SMILESCCOC(=O)N(Cc1cccs1)c1ccccc1
InChIInChI=1S/C14H15NO2S/c1-2-17-14(16)15(11-13-9-6-10-18-13)12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKeyFTMZEMJKXAXRBI-UHFFFAOYSA-N
MW261.35 g/mol
LogP3.91
Rot. Bonds4

About ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate

ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate (PubChem CID 91149975) has the molecular formula C14H15NO2S and a molecular weight of 261.35 g/mol. Its IUPAC name is ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate.

Molecular Properties

Compound Nameethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate
PubChem CID91149975
Molecular FormulaC14H15NO2S
Molecular Weight261.35 g/mol
Exact Mass261.08
IUPAC Nameethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate
SMILESCCOC(=O)N(Cc1cccs1)c1ccccc1
InChIInChI=1S/C14H15NO2S/c1-2-17-14(16)15(11-13-9-6-10-18-13)12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
InChIKeyFTMZEMJKXAXRBI-UHFFFAOYSA-N
XLogP3.91
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.35
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-phenyl-N-(thiophen-2-ylmethyl)acetamide
CID 14292484
2-amino-N-(4-methylphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 39360719
ethyl 2-[bis(thiophen-2-ylmethyl)amino]-2-oxoacetate
CID 166273196
ethyl 2-[propyl(thiophen-2-ylmethyl)amino]acetate
CID 62027701
2-[cyclopropyl(thiophen-2-ylmethyl)amino]-N-ethyl-N-phenylacetamide
CID 134001322
ethyl N-[(2-carbamoyloxyphenyl)methyl]-N-phenylcarbamate
CID 70442873
N-(4-ethoxyphenyl)-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 17013288
ethyl 2-(thionin-2-yl)acetate
CID 174897632
phenyl N-methyl-N-(thiophen-2-ylmethyl)carbamate
CID 60631092
ethyl N-(6-methylheptyl)-N-phenylcarbamate
CID 163979854
2-chloro-N-(2-methylphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 39380130
N-(4-ethylphenyl)-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 35180793

Frequently Asked Questions

What is the IUPAC name of ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate?
The IUPAC name of ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate (CID 91149975) is ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate.
What is the SMILES notation for ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate?
The canonical SMILES for ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate is CCOC(=O)N(Cc1cccs1)c1ccccc1.
What is the InChIKey of ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate?
The InChIKey is FTMZEMJKXAXRBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S/c1-2-17-14(16)15(11-13-9-6-10-18-13)12-7-4-3-5-8-12/h3-10H,2,11H2,1H3.
What are the key properties of ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate?
ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate has a molecular weight of 261.35 g/mol, XLogP of 3.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate is sourced from PubChem (CID 91149975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).