methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate

C15H16N2O3S — CID 71937597

IUPACmethyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate
SMILESCOC(=O)N(C)c1ccc(NC(=O)c2ccc(C)s2)cc1
InChIInChI=1S/C15H16N2O3S/c1-10-4-9-13(21-10)14(18)16-11-5-7-12(8-6-11)17(2)15(19)20-3/h4-9H,1-3H3,(H,16,18)
InChIKeyOHLQIBRQSIGONM-UHFFFAOYSA-N
MW304.37 g/mol
LogP3.51
Rot. Bonds3

About methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate

methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate (PubChem CID 71937597) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate.

Molecular Properties

Compound Namemethyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate
PubChem CID71937597
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC Namemethyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate
SMILESCOC(=O)N(C)c1ccc(NC(=O)c2ccc(C)s2)cc1
InChIInChI=1S/C15H16N2O3S/c1-10-4-9-13(21-10)14(18)16-11-5-7-12(8-6-11)17(2)15(19)20-3/h4-9H,1-3H3,(H,16,18)
InChIKeyOHLQIBRQSIGONM-UHFFFAOYSA-N
XLogP3.51
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminophenyl)-5-methylthiophene-2-carboxamide
CID 22612974
5-methyl-N-[4-(methylcarbamoylamino)phenyl]thiophene-2-carboxamide
CID 52555639
N-(4-ethylphenyl)-5-methylthiophene-2-carboxamide
CID 42992010
5-methyl-N-(4-sulfamoylphenyl)thiophene-2-carboxamide
CID 36865757
5-methyl-N-[4-[C-methyl-N-[(5-methylthiophene-2-carbonyl)amino]carbonimidoyl]phenyl]thiophene-2-carboxamide
CID 3448356
N-[4-[[(E)-4-(dimethylamino)but-2-enoyl]amino]phenyl]-5-methylthiophene-2-carboxamide
CID 176557413
N-(3-chloro-4-methoxyphenyl)-5-methylthiophene-2-carboxamide
CID 1245952
N-(4-hydroxy-3-methylphenyl)-5-methylthiophene-2-carboxamide
CID 14989717
methyl N-methyl-N-[4-[(2-oxo-1H-quinoline-4-carbonyl)amino]phenyl]carbamate
CID 94650278
methyl N-[4-[(4-bromo-2-fluorobenzoyl)amino]phenyl]-N-methylcarbamate
CID 60578589
N-(3-chloro-4-hydroxyphenyl)-5-methylthiophene-2-carboxamide
CID 63935507
5-bromo-N-[4-(diethylamino)phenyl]thiophene-2-carboxamide
CID 27229207

Frequently Asked Questions

What is the IUPAC name of methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate?
The IUPAC name of methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate (CID 71937597) is methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate.
What is the SMILES notation for methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate?
The canonical SMILES for methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate is COC(=O)N(C)c1ccc(NC(=O)c2ccc(C)s2)cc1.
What is the InChIKey of methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate?
The InChIKey is OHLQIBRQSIGONM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c1-10-4-9-13(21-10)14(18)16-11-5-7-12(8-6-11)17(2)15(19)20-3/h4-9H,1-3H3,(H,16,18).
What are the key properties of methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate?
methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate has a molecular weight of 304.37 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-methyl-N-[4-[(5-methylthiophene-2-carbonyl)amino]phenyl]carbamate is sourced from PubChem (CID 71937597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).