N-thiophen-2-ylcarbamate

C5H4NO2S- — CID 19956166

IUPACN-thiophen-2-ylcarbamate
SMILESO=C([O-])Nc1cccs1
InChIInChI=1S/C5H5NO2S/c7-5(8)6-4-2-1-3-9-4/h1-3,6H,(H,7,8)/p-1
InChIKeyVNMLVHLVBFHHSN-UHFFFAOYSA-M
MW142.16 g/mol
LogP0.50
Rot. Bonds1

About N-thiophen-2-ylcarbamate

N-thiophen-2-ylcarbamate (PubChem CID 19956166) has the molecular formula C5H4NO2S- and a molecular weight of 142.16 g/mol. Its IUPAC name is N-thiophen-2-ylcarbamate.

Molecular Properties

Compound NameN-thiophen-2-ylcarbamate
PubChem CID19956166
Molecular FormulaC5H4NO2S-
Molecular Weight142.16 g/mol
Exact Mass142.00
IUPAC NameN-thiophen-2-ylcarbamate
SMILESO=C([O-])Nc1cccs1
InChIInChI=1S/C5H5NO2S/c7-5(8)6-4-2-1-3-9-4/h1-3,6H,(H,7,8)/p-1
InChIKeyVNMLVHLVBFHHSN-UHFFFAOYSA-M
XLogP0.50
TPSA52.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

sodium N-thiophen-2-ylcarbamate
CID 70473734
thiophen-2-ylcarbamic acid
CID 19432670
2-chloro-N-thiophen-2-ylacetamide
CID 21274756
(2S)-2-amino-N-thiophen-2-ylpropanamide
CID 54155210
trifluoromethyl N-thiophen-2-ylcarbamate
CID 13164378
1-(4-hydroxyphenyl)-3-thiophen-2-ylurea
CID 108889117
1-(4-bromophenyl)-3-thiophen-2-ylurea
CID 108889102
1-methyl-1-propan-2-yl-3-thiophen-2-ylurea
CID 131131659
1-(3-chloro-2-methylphenyl)-3-thiophen-2-ylurea
CID 20886019
CID 162245041
CID 162245041
1-(1-hydroxypropan-2-yl)-3-thiophen-2-ylurea
CID 131154153
4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide
CID 115156865

Frequently Asked Questions

What is the IUPAC name of N-thiophen-2-ylcarbamate?
The IUPAC name of N-thiophen-2-ylcarbamate (CID 19956166) is N-thiophen-2-ylcarbamate.
What is the SMILES notation for N-thiophen-2-ylcarbamate?
The canonical SMILES for N-thiophen-2-ylcarbamate is O=C([O-])Nc1cccs1.
What is the InChIKey of N-thiophen-2-ylcarbamate?
The InChIKey is VNMLVHLVBFHHSN-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H5NO2S/c7-5(8)6-4-2-1-3-9-4/h1-3,6H,(H,7,8)/p-1.
What are the key properties of N-thiophen-2-ylcarbamate?
N-thiophen-2-ylcarbamate has a molecular weight of 142.16 g/mol, XLogP of 0.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-thiophen-2-ylcarbamate is sourced from PubChem (CID 19956166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).