2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide

C16H20N2O2S — CID 82056852

IUPAC2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide
SMILESCCNC(=O)c1c(N)sc(CC)c1-c1ccccc1OC
InChIInChI=1S/C16H20N2O2S/c1-4-12-13(10-8-6-7-9-11(10)20-3)14(15(17)21-12)16(19)18-5-2/h6-9H,4-5,17H2,1-3H3,(H,18,19)
InChIKeyRIPXPSAMPSRLQO-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.32
Rot. Bonds5

About 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide

2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide (PubChem CID 82056852) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide
PubChem CID82056852
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC Name2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide
SMILESCCNC(=O)c1c(N)sc(CC)c1-c1ccccc1OC
InChIInChI=1S/C16H20N2O2S/c1-4-12-13(10-8-6-7-9-11(10)20-3)14(15(17)21-12)16(19)18-5-2/h6-9H,4-5,17H2,1-3H3,(H,18,19)
InChIKeyRIPXPSAMPSRLQO-UHFFFAOYSA-N
XLogP3.32
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiophene_amino_Aa(45)', 'substructure': 'N/A'}

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Related Compounds

methyl 2-amino-4-(2,5-dimethoxyphenyl)-5-ethylthiophene-3-carboxylate
CID 92936606
ethyl 2-amino-5-(2-methoxyphenyl)-4-methylthiophene-3-carboxylate
CID 10565518
2-amino-N-ethyl-4-(4-fluorophenyl)-5-methylthiophene-3-carboxamide
CID 82056985
N-ethyl-2-(2-methoxyphenyl)acetamide
CID 3376729
2-amino-N-[(3-ethylthiophen-2-yl)methyl]-6-methoxybenzamide
CID 81420545
2-methylpropyl 2-amino-5-ethyl-4-phenylthiophene-3-carboxylate
CID 82056723
N-[2-(ethylamino)ethyl]-2,6-dimethoxybenzamide
CID 62658406
2-amino-N-ethyl-4-methyl-5-pentylthiophene-3-carboxamide
CID 43367182
2,6-dimethoxybenzohydrazide
CID 2806104
N-benzyl-6-(2-hydroxyethyl)-3-methoxy-2-(2-methoxyphenyl)benzamide
CID 23344374
methyl 3-ethyl-5-fluoro-2-hydroxy-6-(2-methoxyphenyl)-4-methylbenzoate
CID 102273480
2-(2-methoxyphenyl)-4-methyl-1,3-thiazole-5-carbohydrazide
CID 82427033

Frequently Asked Questions

What is the IUPAC name of 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide?
The IUPAC name of 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide (CID 82056852) is 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide?
The canonical SMILES for 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide is CCNC(=O)c1c(N)sc(CC)c1-c1ccccc1OC.
What is the InChIKey of 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide?
The InChIKey is RIPXPSAMPSRLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-4-12-13(10-8-6-7-9-11(10)20-3)14(15(17)21-12)16(19)18-5-2/h6-9H,4-5,17H2,1-3H3,(H,18,19).
What are the key properties of 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide?
2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide has a molecular weight of 304.42 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,5-diethyl-4-(2-methoxyphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 82056852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).