2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide

C21H27N3O2S — CID 42890929

IUPAC2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCCC1c2ccsc2CCN1CC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C21H27N3O2S/c1-2-18-16-8-14-27-20(16)7-9-24(18)15-21(25)22-17-5-3-4-6-19(17)23-10-12-26-13-11-23/h3-6,8,14,18H,2,7,9-13,15H2,1H3,(H,22,25)
InChIKeyBNQFMFQKNSHRPH-UHFFFAOYSA-N
MW385.53 g/mol
LogP3.53
Rot. Bonds5

About 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide

2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide (PubChem CID 42890929) has the molecular formula C21H27N3O2S and a molecular weight of 385.53 g/mol. Its IUPAC name is 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide
PubChem CID42890929
Molecular FormulaC21H27N3O2S
Molecular Weight385.53 g/mol
Exact Mass385.18
IUPAC Name2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide
SMILESCCC1c2ccsc2CCN1CC(=O)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C21H27N3O2S/c1-2-18-16-8-14-27-20(16)7-9-24(18)15-21(25)22-17-5-3-4-6-19(17)23-10-12-26-13-11-23/h3-6,8,14,18H,2,7,9-13,15H2,1H3,(H,22,25)
InChIKeyBNQFMFQKNSHRPH-UHFFFAOYSA-N
XLogP3.53
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.53
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetamide
CID 46482784
2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-N-(2-methylsulfanylphenyl)acetamide
CID 8999966
N-(5-acetamido-2-methoxyphenyl)-2-[(4S)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetamide
CID 26670250
N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)acetamide
CID 18166390
ethyl 2-[[2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetyl]amino]benzoate
CID 8999990
N-(2-cyanophenyl)-2-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]acetamide
CID 8999750
N-(2-morpholin-4-ylphenyl)-2-pyrrol-1-ylacetamide
CID 110688626
N-(2-morpholin-4-ylphenyl)-3-oxobutanamide
CID 18071535
2-bromo-N-(2-morpholin-4-ylphenyl)acetamide
CID 60650852
2-[(2S)-2-(1-methylpyrrol-2-yl)pyrrolidin-1-yl]-N-(2-morpholin-4-ylphenyl)acetamide
CID 7775025
N',N'-diethyl-N-(2-morpholin-4-ylphenyl)propanediamide
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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide (CID 42890929) is 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide is CCC1c2ccsc2CCN1CC(=O)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
The InChIKey is BNQFMFQKNSHRPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N3O2S/c1-2-18-16-8-14-27-20(16)7-9-24(18)15-21(25)22-17-5-3-4-6-19(17)23-10-12-26-13-11-23/h3-6,8,14,18H,2,7,9-13,15H2,1H3,(H,22,25).
What are the key properties of 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide?
2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide has a molecular weight of 385.53 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-(2-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 42890929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).