2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide

C10H20N2OS — CID 154542075

IUPAC2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCN(C=S)CC(=O)NC(C)(C)CC
InChIInChI=1S/C10H20N2OS/c1-5-10(3,4)11-9(13)7-12(6-2)8-14/h8H,5-7H2,1-4H3,(H,11,13)
InChIKeyUPVLBNIBAQANPP-UHFFFAOYSA-N
MW216.35 g/mol
LogP1.57
Rot. Bonds6

About 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide

2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide (PubChem CID 154542075) has the molecular formula C10H20N2OS and a molecular weight of 216.35 g/mol. Its IUPAC name is 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide.

Molecular Properties

Compound Name2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide
PubChem CID154542075
Molecular FormulaC10H20N2OS
Molecular Weight216.35 g/mol
Exact Mass216.13
IUPAC Name2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide
SMILESCCN(C=S)CC(=O)NC(C)(C)CC
InChIInChI=1S/C10H20N2OS/c1-5-10(3,4)11-9(13)7-12(6-2)8-14/h8H,5-7H2,1-4H3,(H,11,13)
InChIKeyUPVLBNIBAQANPP-UHFFFAOYSA-N
XLogP1.57
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.35
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Thiocarbonyl_group', 'substructure': 'N/A'}

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Related Compounds

Acetamide, 2-(diethylamino)-N-tert-pentyl-, hydrochloride
CID 60313
N-tert-butyl-2-(diethylamino)acetamide
CID 60442
(Diethylamino)-N-(2-methylbutan-2-yl)ethanimidic acid--hydrogen chloride (1/1)
CID 131865730
2-(diethylamino)-N-(3-methylpentan-3-yl)acetamide
CID 60236
2-(diethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 60314
N-tert-butyl-2-[(carbamothioylmethyl)(methyl)amino]acetamide
CID 4962723
N-[1-(dimethylamino)-2-methyl-1-sulfanylidenepropan-2-yl]acetamide
CID 13583988
N-tert-butyl-2-(dimethylamino)acetamide
CID 51573390
N-tert-butyl-2-[ethyl(methyl)amino]acetamide
CID 89892662
N-tert-butyl-2-[butyl(methyl)amino]acetamide
CID 109005515
2-(dimethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 123397308
N-tert-butyl-2-[methyl(propyl)amino]acetamide
CID 129033913

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The IUPAC name of 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide (CID 154542075) is 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide.
What is the SMILES notation for 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The canonical SMILES for 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide is CCN(C=S)CC(=O)NC(C)(C)CC.
What is the InChIKey of 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide?
The InChIKey is UPVLBNIBAQANPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2OS/c1-5-10(3,4)11-9(13)7-12(6-2)8-14/h8H,5-7H2,1-4H3,(H,11,13).
What are the key properties of 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide?
2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide has a molecular weight of 216.35 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methanethioyl)amino]-N-(2-methylbutan-2-yl)acetamide is sourced from PubChem (CID 154542075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).