2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid

C17H20N2O5S — CID 119193298

IUPAC2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid
SMILESCc1cc(NC(=O)c2ccco2)sc1C(=O)N(CC(=O)O)CC(C)C
InChIInChI=1S/C17H20N2O5S/c1-10(2)8-19(9-14(20)21)17(23)15-11(3)7-13(25-15)18-16(22)12-5-4-6-24-12/h4-7,10H,8-9H2,1-3H3,(H,18,22)(H,20,21)
InChIKeyRAMRILYSFIOHFD-UHFFFAOYSA-N
MW364.42 g/mol
LogP3.08
Rot. Bonds7

About 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid

2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid (PubChem CID 119193298) has the molecular formula C17H20N2O5S and a molecular weight of 364.42 g/mol. Its IUPAC name is 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid.

Molecular Properties

Compound Name2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid
PubChem CID119193298
Molecular FormulaC17H20N2O5S
Molecular Weight364.42 g/mol
Exact Mass364.11
IUPAC Name2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid
SMILESCc1cc(NC(=O)c2ccco2)sc1C(=O)N(CC(=O)O)CC(C)C
InChIInChI=1S/C17H20N2O5S/c1-10(2)8-19(9-14(20)21)17(23)15-11(3)7-13(25-15)18-16(22)12-5-4-6-24-12/h4-7,10H,8-9H2,1-3H3,(H,18,22)(H,20,21)
InChIKeyRAMRILYSFIOHFD-UHFFFAOYSA-N
XLogP3.08
TPSA99.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.42
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid with MolForge

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Related Compounds

N-[5-[2-methoxyethyl(2-methylpropyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 32954737
2-[cyclopropyl-[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]amino]acetic acid
CID 119195335
N-[5-[butyl(2-hydroxyethyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 78855793
N-[5-[1-(2-methoxyphenyl)ethyl-methylcarbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 55579377
N-[4-methyl-5-[2-(methylamino)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 119501782
N-[5-[2-(ethylamino)ethylcarbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide;hydrochloride
CID 119506646
N-[4-methyl-5-[methyl(3,3,3-trifluoropropyl)carbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 86833515
N-[5-[cyclopentyl(ethyl)carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 134061007
N-[4-methyl-5-(3-propan-2-yloxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
CID 55488982
N-[4-methyl-5-[(4-propan-2-yloxyphenyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 55588228
N-[5-[(2-bromophenyl)methyl-methylcarbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide
CID 38044186
2-[1-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]amino]cyclobutyl]acetic acid
CID 119217971

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid?
The IUPAC name of 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid (CID 119193298) is 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid.
What is the SMILES notation for 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid?
The canonical SMILES for 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid is Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(CC(=O)O)CC(C)C.
What is the InChIKey of 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid?
The InChIKey is RAMRILYSFIOHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O5S/c1-10(2)8-19(9-14(20)21)17(23)15-11(3)7-13(25-15)18-16(22)12-5-4-6-24-12/h4-7,10H,8-9H2,1-3H3,(H,18,22)(H,20,21).
What are the key properties of 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid?
2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid has a molecular weight of 364.42 g/mol, XLogP of 3.08, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(furan-2-carbonylamino)-3-methylthiophene-2-carbonyl]-(2-methylpropyl)amino]acetic acid is sourced from PubChem (CID 119193298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).