2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide

C14H22N2O2S — CID 61487887

IUPAC2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)CNCc1cc2c(s1)CCC2
InChIInChI=1S/C14H22N2O2S/c1-10(9-18-2)16-14(17)8-15-7-12-6-11-4-3-5-13(11)19-12/h6,10,15H,3-5,7-9H2,1-2H3,(H,16,17)
InChIKeyDZLSJZGWTIXYLP-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.48
Rot. Bonds7

About 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide

2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 61487887) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide
PubChem CID61487887
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC Name2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide
SMILESCOCC(C)NC(=O)CNCc1cc2c(s1)CCC2
InChIInChI=1S/C14H22N2O2S/c1-10(9-18-2)16-14(17)8-15-7-12-6-11-4-3-5-13(11)19-12/h6,10,15H,3-5,7-9H2,1-2H3,(H,16,17)
InChIKeyDZLSJZGWTIXYLP-UHFFFAOYSA-N
XLogP1.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide with MolForge

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Related Compounds

2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(2-methoxyethyl)acetamide
CID 54956112
N-(1-methoxypropan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 78800338
N-cyclopentyl-2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)acetamide
CID 61207061
methyl (E)-3-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)prop-2-enoate
CID 103242950
N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-2-(3-methylbutoxy)ethanamine
CID 54955987
4-amino-N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-3-methoxybutanamide
CID 103155467
ethyl 4-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-3-hydroxybutanoate
CID 103242925
3-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)propanamide
CID 61208365
N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-3-methoxybutan-2-amine
CID 115717106
N-(1-methoxypropan-2-yl)-2-[(5-methylpyrazin-2-yl)methylamino]acetamide
CID 62846636
3-chloro-N-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethyl)-2-methylpropanamide
CID 62728528
1-(azepan-1-yl)-2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)propan-1-one
CID 61207981

Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide (CID 61487887) is 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide is COCC(C)NC(=O)CNCc1cc2c(s1)CCC2.
What is the InChIKey of 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is DZLSJZGWTIXYLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-10(9-18-2)16-14(17)8-15-7-12-6-11-4-3-5-13(11)19-12/h6,10,15H,3-5,7-9H2,1-2H3,(H,16,17).
What are the key properties of 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide?
2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 282.41 g/mol, XLogP of 1.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dihydro-4H-cyclopenta[b]thiophen-2-ylmethylamino)-N-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 61487887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).