2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide

C16H19N3O4S — CID 11624450

IUPAC2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide
SMILESCOCCNC(=O)c1cc(-c2ccc(OC)cc2)sc1NC(N)=O
InChIInChI=1S/C16H19N3O4S/c1-22-8-7-18-14(20)12-9-13(24-15(12)19-16(17)21)10-3-5-11(23-2)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,18,20)(H3,17,19,21)
InChIKeyUNHADVKHGAIWFT-UHFFFAOYSA-N
MW349.41 g/mol
LogP2.29
Rot. Bonds7

About 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide

2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide (PubChem CID 11624450) has the molecular formula C16H19N3O4S and a molecular weight of 349.41 g/mol. Its IUPAC name is 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide
PubChem CID11624450
Molecular FormulaC16H19N3O4S
Molecular Weight349.41 g/mol
Exact Mass349.11
IUPAC Name2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide
SMILESCOCCNC(=O)c1cc(-c2ccc(OC)cc2)sc1NC(N)=O
InChIInChI=1S/C16H19N3O4S/c1-22-8-7-18-14(20)12-9-13(24-15(12)19-16(17)21)10-3-5-11(23-2)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,18,20)(H3,17,19,21)
InChIKeyUNHADVKHGAIWFT-UHFFFAOYSA-N
XLogP2.29
TPSA102.68 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 52.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-aminoethyl)-2-(carbamoylamino)-5-(4-methoxyphenyl)thiophene-3-carboxamide
CID 11624156
2-(carbamoylamino)-5-(4-methoxyphenyl)-N-(2-phenoxyethyl)thiophene-3-carboxamide
CID 11560615
N-(1,3-benzodioxol-5-ylmethyl)-2-(carbamoylamino)-5-(4-methoxyphenyl)thiophene-3-carboxamide
CID 11711566
2-(carbamoylamino)-5-(4-methoxyphenyl)-N-[1-(2-phenylethyl)piperidin-4-yl]thiophene-3-carboxamide
CID 174506569
[3-(1,4-diazepane-1-carbonyl)-5-(4-methoxyphenyl)thiophen-2-yl]urea
CID 11494523
2-(carbamoylamino)-5-[4-[[ethyl(2-methoxyethyl)amino]methyl]phenyl]thiophene-3-carboxamide
CID 10317409
[3-[(3S)-3-aminoazepane-1-carbonyl]-5-(4-methoxyphenyl)thiophen-2-yl]urea;hydrochloride
CID 68960850
2-(carbamoylamino)-5-[4-(methylaminomethyl)phenyl]thiophene-3-carboxamide
CID 44560752
2-(carbamoylamino)-5-(4-chlorophenyl)thiophene-3-carboxamide;2-(carbamoylamino)-5-(3,4-dichlorophenyl)thiophene-3-carboxamide;2-(carbamoylamino)-5-[3-(hydroxymethyl)phenyl]thiophene-3-carboxamide;2-(carbamoylamino)-5-(3-methoxyphenyl)thiophene-3-carboxamide;2-(carbamoylamino)-5-(4-methoxyphenyl)thiophene-3-carboxamide
CID 173236287
2-acetamido-N-(3-methoxyphenyl)-5-phenylthiophene-3-carboxamide
CID 7673753
[2-(carbamoylamino)-5-(4-methoxyphenyl)thiophen-3-yl] N-[(3R)-pyrrolidin-3-yl]carbamate
CID 69153822
3-amino-5-(4-methoxyphenyl)thiophene-2-carbohydrazide
CID 7131039

Frequently Asked Questions

What is the IUPAC name of 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide?
The IUPAC name of 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide (CID 11624450) is 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide.
What is the SMILES notation for 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide?
The canonical SMILES for 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide is COCCNC(=O)c1cc(-c2ccc(OC)cc2)sc1NC(N)=O.
What is the InChIKey of 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide?
The InChIKey is UNHADVKHGAIWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O4S/c1-22-8-7-18-14(20)12-9-13(24-15(12)19-16(17)21)10-3-5-11(23-2)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,18,20)(H3,17,19,21).
What are the key properties of 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide?
2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide has a molecular weight of 349.41 g/mol, XLogP of 2.29, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(carbamoylamino)-N-(2-methoxyethyl)-5-(4-methoxyphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 11624450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).