N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide

C10H17NOS — CID 57068739

IUPACN-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide
SMILESCCCC1(C)SC=CC1NC(C)=O
InChIInChI=1S/C10H17NOS/c1-4-6-10(3)9(5-7-13-10)11-8(2)12/h5,7,9H,4,6H2,1-3H3,(H,11,12)
InChIKeyQRGWBSKBDQUMHO-UHFFFAOYSA-N
MW199.32 g/mol
LogP2.31
Rot. Bonds3

About N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide

N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide (PubChem CID 57068739) has the molecular formula C10H17NOS and a molecular weight of 199.32 g/mol. Its IUPAC name is N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide
PubChem CID57068739
Molecular FormulaC10H17NOS
Molecular Weight199.32 g/mol
Exact Mass199.10
IUPAC NameN-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide
SMILESCCCC1(C)SC=CC1NC(C)=O
InChIInChI=1S/C10H17NOS/c1-4-6-10(3)9(5-7-13-10)11-8(2)12/h5,7,9H,4,6H2,1-3H3,(H,11,12)
InChIKeyQRGWBSKBDQUMHO-UHFFFAOYSA-N
XLogP2.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.32
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide?
The IUPAC name of N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide (CID 57068739) is N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide.
What is the SMILES notation for N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide?
The canonical SMILES for N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide is CCCC1(C)SC=CC1NC(C)=O.
What is the InChIKey of N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide?
The InChIKey is QRGWBSKBDQUMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NOS/c1-4-6-10(3)9(5-7-13-10)11-8(2)12/h5,7,9H,4,6H2,1-3H3,(H,11,12).
What are the key properties of N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide?
N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide has a molecular weight of 199.32 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-2-propyl-3H-thiophen-3-yl)acetamide is sourced from PubChem (CID 57068739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).