4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide

C10H16N2OS — CID 115156865

IUPAC4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide
SMILESCC(C)(CCN)C(=O)Nc1cccs1
InChIInChI=1S/C10H16N2OS/c1-10(2,5-6-11)9(13)12-8-4-3-7-14-8/h3-4,7H,5-6,11H2,1-2H3,(H,12,13)
InChIKeyYHJHXNUYWPQANQ-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.06
Rot. Bonds4

About 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide

4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide (PubChem CID 115156865) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide.

Molecular Properties

Compound Name4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide
PubChem CID115156865
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide
SMILESCC(C)(CCN)C(=O)Nc1cccs1
InChIInChI=1S/C10H16N2OS/c1-10(2,5-6-11)9(13)12-8-4-3-7-14-8/h3-4,7H,5-6,11H2,1-2H3,(H,12,13)
InChIKeyYHJHXNUYWPQANQ-UHFFFAOYSA-N
XLogP2.06
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-(5-chlorothiophen-2-yl)-2,2-dimethylbutanamide
CID 115156873
4-amino-2,2-dimethyl-N-(2-thiophen-2-ylethyl)butanamide
CID 115157089
4-amino-2,2-dimethyl-N-(2-methyl-2-thiophen-2-ylpropyl)butanamide
CID 115157160
2-chloro-N-thiophen-2-ylacetamide
CID 21274756
tert-butyl N-(2-aminoethyl)-N-(thiophen-2-ylcarbamoyl)carbamate
CID 108889283
thiophen-2-ylcarbamic acid
CID 19432670
(2S)-2-amino-N-thiophen-2-ylpropanamide
CID 54155210
4-amino-2,2-dimethyl-N-(1H-pyrrol-3-yl)butanamide
CID 115156893
N-thiophen-2-ylcarbamate
CID 19956166
1-(2,2-difluoro-3,3-dimethylbutyl)-3-thiophen-2-ylurea
CID 58044673
trifluoromethyl N-thiophen-2-ylcarbamate
CID 13164378
sodium N-thiophen-2-ylcarbamate
CID 70473734

Frequently Asked Questions

What is the IUPAC name of 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide?
The IUPAC name of 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide (CID 115156865) is 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide.
What is the SMILES notation for 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide?
The canonical SMILES for 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide is CC(C)(CCN)C(=O)Nc1cccs1.
What is the InChIKey of 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide?
The InChIKey is YHJHXNUYWPQANQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-10(2,5-6-11)9(13)12-8-4-3-7-14-8/h3-4,7H,5-6,11H2,1-2H3,(H,12,13).
What are the key properties of 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide?
4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide has a molecular weight of 212.32 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2,2-dimethyl-N-thiophen-2-ylbutanamide is sourced from PubChem (CID 115156865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).