3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide

C10H16N2O2S — CID 106111308

IUPAC3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide
SMILESCOC(CN)C(=O)N(C)Cc1ccsc1
InChIInChI=1S/C10H16N2O2S/c1-12(6-8-3-4-15-7-8)10(13)9(5-11)14-2/h3-4,7,9H,5-6,11H2,1-2H3
InChIKeyPNANXTAUMJBORV-UHFFFAOYSA-N
MW228.32 g/mol
LogP0.68
Rot. Bonds5

About 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide

3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide (PubChem CID 106111308) has the molecular formula C10H16N2O2S and a molecular weight of 228.32 g/mol. Its IUPAC name is 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide
PubChem CID106111308
Molecular FormulaC10H16N2O2S
Molecular Weight228.32 g/mol
Exact Mass228.09
IUPAC Name3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide
SMILESCOC(CN)C(=O)N(C)Cc1ccsc1
InChIInChI=1S/C10H16N2O2S/c1-12(6-8-3-4-15-7-8)10(13)9(5-11)14-2/h3-4,7,9H,5-6,11H2,1-2H3
InChIKeyPNANXTAUMJBORV-UHFFFAOYSA-N
XLogP0.68
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.32
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[(3,4-dimethoxyphenyl)methyl]-2-methoxy-N-methylpropanamide
CID 106111912
3-amino-N-[(4-bromothiophen-2-yl)methyl]-2-methoxy-N-methylpropanamide
CID 106112087
3-amino-N-[(3-fluorophenyl)methyl]-2-methoxy-N-methylpropanamide
CID 106111202
3-amino-N-[(4-cyanophenyl)methyl]-2-methoxy-N-methylpropanamide
CID 106112028
3-amino-2-methoxy-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 106111942
2,2,2-trifluoro-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 62733557
methyl 2-methyl-3-[methyl(thiophen-3-ylmethyl)amino]butanoate
CID 79407741
N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide
CID 39966816
1-methyl-3-propan-2-yl-1-(thiophen-3-ylmethyl)urea
CID 53016506
4,4-dimethoxy-2-N-methyl-2-N-(thiophen-3-ylmethyl)butane-1,2-diamine
CID 66269559
3-methoxy-4-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]butanoic acid
CID 103158614
2-amino-N,2-dimethyl-N-(thiophen-3-ylmethyl)butanamide
CID 79797348

Frequently Asked Questions

What is the IUPAC name of 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide?
The IUPAC name of 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide (CID 106111308) is 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide.
What is the SMILES notation for 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide?
The canonical SMILES for 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide is COC(CN)C(=O)N(C)Cc1ccsc1.
What is the InChIKey of 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide?
The InChIKey is PNANXTAUMJBORV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2S/c1-12(6-8-3-4-15-7-8)10(13)9(5-11)14-2/h3-4,7,9H,5-6,11H2,1-2H3.
What are the key properties of 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide?
3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide has a molecular weight of 228.32 g/mol, XLogP of 0.68, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2-methoxy-N-methyl-N-(thiophen-3-ylmethyl)propanamide is sourced from PubChem (CID 106111308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).