N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide

C8H10ClNOS — CID 131207227

IUPACN-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(Cl)s1
InChIInChI=1S/C8H10ClNOS/c1-5(10-6(2)11)7-3-4-8(9)12-7/h3-5H,1-2H3,(H,10,11)/t5-/m1/s1
InChIKeyOJMXEMQLTQTNJY-RXMQYKEDSA-N
MW203.69 g/mol
LogP2.60
Rot. Bonds2

About N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide

N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide (PubChem CID 131207227) has the molecular formula C8H10ClNOS and a molecular weight of 203.69 g/mol. Its IUPAC name is N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide
PubChem CID131207227
Molecular FormulaC8H10ClNOS
Molecular Weight203.69 g/mol
Exact Mass203.02
IUPAC NameN-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide
SMILESCC(=O)N[C@H](C)c1ccc(Cl)s1
InChIInChI=1S/C8H10ClNOS/c1-5(10-6(2)11)7-3-4-8(9)12-7/h3-5H,1-2H3,(H,10,11)/t5-/m1/s1
InChIKeyOJMXEMQLTQTNJY-RXMQYKEDSA-N
XLogP2.60
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.69
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl N-[1-(5-chlorothiophen-2-yl)ethyl]carbamate
CID 115579886
2-bromo-N-[1-(5-chlorothiophen-2-yl)ethyl]propanamide
CID 107903709
(2R)-2-amino-N-[1-(5-chlorothiophen-2-yl)ethyl]-3,3-dimethylbutanamide
CID 103928730
N-[1-(5-chlorothiophen-2-yl)ethyl]but-2-enamide
CID 112726739
(1R)-2,2-dichloro-N-[(1S)-1-(5-chlorothiophen-2-yl)ethyl]-1-methylcyclopropane-1-carboxamide
CID 39271937
3-amino-N-[1-(5-chlorothiophen-2-yl)ethyl]-2,2,3-trimethylbutanamide
CID 65264508
1-butan-2-yl-3-[1-(5-chlorothiophen-2-yl)ethyl]urea
CID 17217672
N-[1-(5-chlorothiophen-2-yl)ethyl]-2,6-dihydroxybenzamide
CID 103749027
(Z)-N-[1-(5-chlorothiophen-2-yl)ethyl]-2-methylpent-2-enamide
CID 47028293
3-amino-N-[1-(5-chlorothiophen-2-yl)ethyl]propanamide;hydrochloride
CID 119287389
N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]-5-methylthiophene-2-carboxamide
CID 39272941
1-(5-chlorothiophen-2-yl)-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanamine
CID 43692517

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide?
The IUPAC name of N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide (CID 131207227) is N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide?
The canonical SMILES for N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide is CC(=O)N[C@H](C)c1ccc(Cl)s1.
What is the InChIKey of N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide?
The InChIKey is OJMXEMQLTQTNJY-RXMQYKEDSA-N. The full InChI is InChI=1S/C8H10ClNOS/c1-5(10-6(2)11)7-3-4-8(9)12-7/h3-5H,1-2H3,(H,10,11)/t5-/m1/s1.
What are the key properties of N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide?
N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide has a molecular weight of 203.69 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide is sourced from PubChem (CID 131207227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).