4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide

C10H16N2OS — CID 43527540

IUPAC4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide
SMILESCN(Cc1cccs1)C(=O)CCCN
InChIInChI=1S/C10H16N2OS/c1-12(10(13)5-2-6-11)8-9-4-3-7-14-9/h3-4,7H,2,5-6,8,11H2,1H3
InChIKeyHSIXDFVVVTWYCT-UHFFFAOYSA-N
MW212.32 g/mol
LogP1.45
Rot. Bonds5

About 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide

4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide (PubChem CID 43527540) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide.

Molecular Properties

Compound Name4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide
PubChem CID43527540
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC Name4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide
SMILESCN(Cc1cccs1)C(=O)CCCN
InChIInChI=1S/C10H16N2OS/c1-12(10(13)5-2-6-11)8-9-4-3-7-14-9/h3-4,7H,2,5-6,8,11H2,1H3
InChIKeyHSIXDFVVVTWYCT-UHFFFAOYSA-N
XLogP1.45
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-hydroxy-N-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 79201475
N-methyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 110733634
3-hydroxy-N-methyl-N-(thiophen-2-ylmethyl)propanamide
CID 115139118
3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119681753
N-(3-amino-2,2-dimethylpropyl)-N-methyl-4-thiophen-2-ylbutanamide
CID 79652321
4-amino-N-methyl-N-[(3-methylthiophen-2-yl)methyl]butanamide
CID 60939275
2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 43527191
5-[methyl(2-thiophen-2-ylethyl)amino]-5-oxopentanoic acid
CID 79476519
(2R)-2-amino-N,3-dimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 79011600
4-chloro-N-[3-[methyl(thiophen-2-ylmethyl)amino]-3-oxopropyl]benzamide
CID 7779935
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 79652724
4-[[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]amino]butanoic acid
CID 43473843

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide?
The IUPAC name of 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide (CID 43527540) is 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide.
What is the SMILES notation for 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide?
The canonical SMILES for 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide is CN(Cc1cccs1)C(=O)CCCN.
What is the InChIKey of 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide?
The InChIKey is HSIXDFVVVTWYCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-12(10(13)5-2-6-11)8-9-4-3-7-14-9/h3-4,7H,2,5-6,8,11H2,1H3.
What are the key properties of 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide?
4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide has a molecular weight of 212.32 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide is sourced from PubChem (CID 43527540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).