methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate

C16H16N2O6S — CID 7167041

IUPACmethyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate
SMILESCOC(=O)NC(=O)c1ccsc1NC(=O)c1ccc(OC)cc1OC
InChIInChI=1S/C16H16N2O6S/c1-22-9-4-5-10(12(8-9)23-2)13(19)17-15-11(6-7-25-15)14(20)18-16(21)24-3/h4-8H,1-3H3,(H,17,19)(H,18,20,21)
InChIKeyGIZNEWCWUIEZEP-UHFFFAOYSA-N
MW364.38 g/mol
LogP2.51
Rot. Bonds5

About methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate

methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate (PubChem CID 7167041) has the molecular formula C16H16N2O6S and a molecular weight of 364.38 g/mol. Its IUPAC name is methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate.

Molecular Properties

Compound Namemethyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate
PubChem CID7167041
Molecular FormulaC16H16N2O6S
Molecular Weight364.38 g/mol
Exact Mass364.07
IUPAC Namemethyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate
SMILESCOC(=O)NC(=O)c1ccsc1NC(=O)c1ccc(OC)cc1OC
InChIInChI=1S/C16H16N2O6S/c1-22-9-4-5-10(12(8-9)23-2)13(19)17-15-11(6-7-25-15)14(20)18-16(21)24-3/h4-8H,1-3H3,(H,17,19)(H,18,20,21)
InChIKeyGIZNEWCWUIEZEP-UHFFFAOYSA-N
XLogP2.51
TPSA102.96 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.38
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[(2,4-dimethoxybenzoyl)amino]-N-methylthiophene-3-carboxamide
CID 5228480
methyl N-[2-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]thiophene-3-carbonyl]carbamate
CID 41320632
methyl N-[2-[(5-methyl-1,2-oxazole-3-carbonyl)amino]thiophene-3-carbonyl]carbamate
CID 16953741
methyl N-[2-[(3-butoxybenzoyl)amino]thiophene-3-carbonyl]carbamate
CID 7167065
methyl N-[2-[(6-methoxy-1,3-benzothiazol-2-yl)amino]thiophene-3-carbonyl]carbamate
CID 7158844
N-(2-iodophenyl)-2,4-dimethoxybenzamide
CID 3340182
2,4-dimethoxy-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 670331
ethyl N-[2-[[2-(4-methoxyphenyl)acetyl]amino]thiophene-3-carbonyl]carbamate
CID 8719049
2-[(2,4-dimethoxybenzoyl)amino]-4,5-dimethylthiophene-3-carboxamide
CID 844073
N-[4-(chloromethyl)-1,3-thiazol-2-yl]-2,4-dimethoxybenzamide
CID 43140311
2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide
CID 793888
N-[(4-acetamidophenyl)carbamothioyl]-2,4-dimethoxybenzamide
CID 17274760

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate?
The IUPAC name of methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate (CID 7167041) is methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate.
What is the SMILES notation for methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate?
The canonical SMILES for methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate is COC(=O)NC(=O)c1ccsc1NC(=O)c1ccc(OC)cc1OC.
What is the InChIKey of methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate?
The InChIKey is GIZNEWCWUIEZEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O6S/c1-22-9-4-5-10(12(8-9)23-2)13(19)17-15-11(6-7-25-15)14(20)18-16(21)24-3/h4-8H,1-3H3,(H,17,19)(H,18,20,21).
What are the key properties of methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate?
methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate has a molecular weight of 364.38 g/mol, XLogP of 2.51, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-[(2,4-dimethoxybenzoyl)amino]thiophene-3-carbonyl]carbamate is sourced from PubChem (CID 7167041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).