2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide

C13H20N2OS — CID 79853944

IUPAC2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide
SMILESCC(Cc1ccsc1)NC(=O)CC1(N)CCC1
InChIInChI=1S/C13H20N2OS/c1-10(7-11-3-6-17-9-11)15-12(16)8-13(14)4-2-5-13/h3,6,9-10H,2,4-5,7-8,14H2,1H3,(H,15,16)
InChIKeyOFGZXETTYASJSE-UHFFFAOYSA-N
MW252.38 g/mol
LogP2.07
Rot. Bonds5

About 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide

2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide (PubChem CID 79853944) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide
PubChem CID79853944
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC Name2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide
SMILESCC(Cc1ccsc1)NC(=O)CC1(N)CCC1
InChIInChI=1S/C13H20N2OS/c1-10(7-11-3-6-17-9-11)15-12(16)8-13(14)4-2-5-13/h3,6,9-10H,2,4-5,7-8,14H2,1H3,(H,15,16)
InChIKeyOFGZXETTYASJSE-UHFFFAOYSA-N
XLogP2.07
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(aminomethyl)cyclobutyl]-N-(1-thiophen-3-ylpropan-2-yl)acetamide
CID 81168869
1-carbamothioyl-N-(1-thiophen-3-ylpropan-2-yl)cyclobutane-1-carboxamide
CID 80588942
2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide
CID 64679741
3-(propan-2-ylamino)-N-(1-thiophen-3-ylpropan-2-yl)propanamide
CID 54953742
1-cyano-N-(1-thiophen-3-ylpropan-2-yl)cyclobutane-1-carboxamide
CID 78994589
1-amino-3-methyl-N-(1-thiophen-3-ylpropan-2-yl)cyclohexane-1-carboxamide
CID 64553804
2-(1-aminocyclopentyl)-N-[1-(5-methylthiophen-2-yl)propan-2-yl]acetamide
CID 64678109
1-thiophen-3-ylpropan-2-ylthiourea
CID 61473973
2-piperidin-3-yl-N-(1-thiophen-3-ylpropan-2-yl)acetamide
CID 62676356
3-(ethylamino)-N-(1-thiophen-3-ylpropan-2-yl)butanamide
CID 62831629
4-amino-3-methoxy-N-(1-thiophen-3-ylpropan-2-yl)butanamide
CID 103155651
(2S)-2-amino-3-methyl-N-(1-thiophen-3-ylpropan-2-yl)butanamide
CID 61474644

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide?
The IUPAC name of 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide (CID 79853944) is 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide is CC(Cc1ccsc1)NC(=O)CC1(N)CCC1.
What is the InChIKey of 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide?
The InChIKey is OFGZXETTYASJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-10(7-11-3-6-17-9-11)15-12(16)8-13(14)4-2-5-13/h3,6,9-10H,2,4-5,7-8,14H2,1H3,(H,15,16).
What are the key properties of 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide?
2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide has a molecular weight of 252.38 g/mol, XLogP of 2.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclobutyl)-N-(1-thiophen-3-ylpropan-2-yl)acetamide is sourced from PubChem (CID 79853944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).