N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide

C12H19NOS — CID 803105

IUPACN,N-di(propan-2-yl)-2-thiophen-2-ylacetamide
SMILESCC(C)N(C(=O)Cc1cccs1)C(C)C
InChIInChI=1S/C12H19NOS/c1-9(2)13(10(3)4)12(14)8-11-6-5-7-15-11/h5-7,9-10H,8H2,1-4H3
InChIKeyDVVFTAMQSZGENH-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.94
Rot. Bonds4

About N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide

N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide (PubChem CID 803105) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN,N-di(propan-2-yl)-2-thiophen-2-ylacetamide
PubChem CID803105
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC NameN,N-di(propan-2-yl)-2-thiophen-2-ylacetamide
SMILESCC(C)N(C(=O)Cc1cccs1)C(C)C
InChIInChI=1S/C12H19NOS/c1-9(2)13(10(3)4)12(14)8-11-6-5-7-15-11/h5-7,9-10H,8H2,1-4H3
InChIKeyDVVFTAMQSZGENH-UHFFFAOYSA-N
XLogP2.94
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,2,2-trimethyl-N-[(5-methylthiophen-2-yl)methyl]butanamide
CID 60236671
N,2,2-trimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 121446738
1-(Methylsulfonyl)-4-(2-thienylacetyl)piperazine
CID 1246104
(5Z,8Z,11Z,14Z)-N-(1-thiophen-2-ylpropan-2-yl)icosa-5,8,11,14-tetraenamide
CID 10928080
Icosa-5,8,11,14-tetraenoic acid (2-thiophen-2-yl-ethyl)-amide
CID 10949701
N-methyl-N-[(1R,2R)-2-pyrrolidin-1-ylcyclohexyl]-2-thiophen-2-ylacetamide;hydrochloride
CID 45263010
2-[(2S)-4-methylsulfanyl-2-[(2-thiophen-2-ylacetyl)amino]butanoyl]sulfanylacetic acid
CID 122180364
2-[(2S)-1-(2-thiophen-2-ylacetyl)pyrrolidine-2-carbonyl]sulfanylacetic acid
CID 122180369
N-cyclopentyl-2-(2-thienyl)acetamide
CID 669859
Morpholine, 4-(2-thienylacetyl)-
CID 531781
Icosa-5,8,11,14-tetraenoic acid bis-thiophen-2-ylmethyl-amide
CID 10973077
N,N-bis(cyanomethyl)-2-thiophen-2-ylacetamide
CID 842500

Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide (CID 803105) is N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide is CC(C)N(C(=O)Cc1cccs1)C(C)C.
What is the InChIKey of N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide?
The InChIKey is DVVFTAMQSZGENH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c1-9(2)13(10(3)4)12(14)8-11-6-5-7-15-11/h5-7,9-10H,8H2,1-4H3.
What are the key properties of N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide?
N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide has a molecular weight of 225.36 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 803105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).