2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide

C15H16ClNO2S — CID 66792494

IUPAC2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide
SMILESCCc1ccc(-c2ccc(C(=O)NCCO)c(Cl)c2)s1
InChIInChI=1S/C15H16ClNO2S/c1-2-11-4-6-14(20-11)10-3-5-12(13(16)9-10)15(19)17-7-8-18/h3-6,9,18H,2,7-8H2,1H3,(H,17,19)
InChIKeyRQCMONYFAMCRQJ-UHFFFAOYSA-N
MW309.82 g/mol
LogP3.35
Rot. Bonds5

About 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide

2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide (PubChem CID 66792494) has the molecular formula C15H16ClNO2S and a molecular weight of 309.82 g/mol. Its IUPAC name is 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide
PubChem CID66792494
Molecular FormulaC15H16ClNO2S
Molecular Weight309.82 g/mol
Exact Mass309.06
IUPAC Name2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide
SMILESCCc1ccc(-c2ccc(C(=O)NCCO)c(Cl)c2)s1
InChIInChI=1S/C15H16ClNO2S/c1-2-11-4-6-14(20-11)10-3-5-12(13(16)9-10)15(19)17-7-8-18/h3-6,9,18H,2,7-8H2,1H3,(H,17,19)
InChIKeyRQCMONYFAMCRQJ-UHFFFAOYSA-N
XLogP3.35
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.82
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide (CID 66792494) is 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide is CCc1ccc(-c2ccc(C(=O)NCCO)c(Cl)c2)s1.
What is the InChIKey of 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide?
The InChIKey is RQCMONYFAMCRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNO2S/c1-2-11-4-6-14(20-11)10-3-5-12(13(16)9-10)15(19)17-7-8-18/h3-6,9,18H,2,7-8H2,1H3,(H,17,19).
What are the key properties of 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide?
2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide has a molecular weight of 309.82 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(5-ethylthiophen-2-yl)-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 66792494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).