2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid

C11H14N2O6S — CID 119213842

IUPAC2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid
SMILESCc1oc(C(=O)NC(C(=O)O)C2CC2)cc1S(N)(=O)=O
InChIInChI=1S/C11H14N2O6S/c1-5-8(20(12,17)18)4-7(19-5)10(14)13-9(11(15)16)6-2-3-6/h4,6,9H,2-3H2,1H3,(H,13,14)(H,15,16)(H2,12,17,18)
InChIKeyZVDUXHKSHBMPMR-UHFFFAOYSA-N
MW302.31 g/mol
LogP-0.17
Rot. Bonds5

About 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid

2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid (PubChem CID 119213842) has the molecular formula C11H14N2O6S and a molecular weight of 302.31 g/mol. Its IUPAC name is 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid
PubChem CID119213842
Molecular FormulaC11H14N2O6S
Molecular Weight302.31 g/mol
Exact Mass302.06
IUPAC Name2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid
SMILESCc1oc(C(=O)NC(C(=O)O)C2CC2)cc1S(N)(=O)=O
InChIInChI=1S/C11H14N2O6S/c1-5-8(20(12,17)18)4-7(19-5)10(14)13-9(11(15)16)6-2-3-6/h4,6,9H,2-3H2,1H3,(H,13,14)(H,15,16)(H2,12,17,18)
InChIKeyZVDUXHKSHBMPMR-UHFFFAOYSA-N
XLogP-0.17
TPSA139.70 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.31
LogP ≤ 5-0.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclobutyl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65389029
N-hexan-2-yl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65387104
N-cyclohexyl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65374556
4-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 119230045
5-methyl-4-sulfamoyl-N-(3-tricyclo[3.2.1.02,4]octanyl)furan-2-carboxamide
CID 103767080
5-bromo-N-(1-cyclopropylethyl)-4-sulfamoylfuran-2-carboxamide
CID 65388940
2-cyclopropyl-2-[(5-methylfuro[3,2-b]pyridine-2-carbonyl)amino]acetic acid
CID 119213563
2-cyclopropyl-2-[(4,5-diethylfuran-2-carbonyl)amino]acetic acid
CID 120686714
N-(1-amino-4-methylpentan-2-yl)-5-methyl-4-sulfamoylfuran-2-carboxamide;hydrochloride
CID 119588835
2-[(3,4-dimethyl-5-sulfamoylbenzoyl)amino]-2-(oxan-3-yl)acetic acid
CID 120548532
N-cyclopropyl-N,5-dimethyl-4-sulfamoylfuran-2-carboxamide
CID 65374093
N-(1-amino-2,3-dimethylbutan-2-yl)-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 119609057

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid?
The IUPAC name of 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid (CID 119213842) is 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid?
The canonical SMILES for 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid is Cc1oc(C(=O)NC(C(=O)O)C2CC2)cc1S(N)(=O)=O.
What is the InChIKey of 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid?
The InChIKey is ZVDUXHKSHBMPMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O6S/c1-5-8(20(12,17)18)4-7(19-5)10(14)13-9(11(15)16)6-2-3-6/h4,6,9H,2-3H2,1H3,(H,13,14)(H,15,16)(H2,12,17,18).
What are the key properties of 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid?
2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid has a molecular weight of 302.31 g/mol, XLogP of -0.17, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-[(5-methyl-4-sulfamoylfuran-2-carbonyl)amino]acetic acid is sourced from PubChem (CID 119213842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).