2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione

C10H8ClNO3 — CID 149261834

IUPAC2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione
SMILESCc1c(Cl)oc2c1C(=O)N(C1CC1)C2=O
InChIInChI=1S/C10H8ClNO3/c1-4-6-7(15-8(4)11)10(14)12(9(6)13)5-2-3-5/h5H,2-3H2,1H3
InChIKeyXPJPABQZOQQDTB-UHFFFAOYSA-N
MW225.63 g/mol
LogP2.00
Rot. Bonds1

About 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione

2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione (PubChem CID 149261834) has the molecular formula C10H8ClNO3 and a molecular weight of 225.63 g/mol. Its IUPAC name is 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione.

Molecular Properties

Compound Name2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione
PubChem CID149261834
Molecular FormulaC10H8ClNO3
Molecular Weight225.63 g/mol
Exact Mass225.02
IUPAC Name2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione
SMILESCc1c(Cl)oc2c1C(=O)N(C1CC1)C2=O
InChIInChI=1S/C10H8ClNO3/c1-4-6-7(15-8(4)11)10(14)12(9(6)13)5-2-3-5/h5H,2-3H2,1H3
InChIKeyXPJPABQZOQQDTB-UHFFFAOYSA-N
XLogP2.00
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.63
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-hydroxycyclohexyl)-4,7-dimethylisoindole-1,3-dione
CID 103430870
4,7-dichloro-2-cyclopentylisoindole-1,3-dione
CID 25144342
3,4-dimethyl-1-[4-(methylamino)cyclohexyl]pyrrole-2,5-dione
CID 79110425
3,4-dichloro-1-cyclohexylpyrrole-2,5-dione
CID 729254
10,11,14,15,21,22,25,26-octachloro-7,18-dicyclohexyl-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone
CID 58194115
tert-butyl 4-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)cyclohexane-1-carboperoxoate
CID 101203755
4,5,6,7-tetrabromo-2-cyclohexylisoindole-1,3-dione
CID 17386857
2-cyclohexyl-4,5,6,7-tetrafluoroisoindole-1,3-dione
CID 14274184
3-chloro-1-cyclohexyl-4-(4-methylpiperazin-1-yl)pyrrole-2,5-dione
CID 645488
3-chloro-1-cyclododecyl-4-(4-methylphenyl)pyrrole-2,5-dione
CID 110584204
4-amino-2-(4-methylcyclohexyl)isoindole-1,3-dione
CID 43209492
2-(azetidin-3-yl)-4,7-dimethylisoindole-1,3-dione
CID 103430966

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione?
The IUPAC name of 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione (CID 149261834) is 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione.
What is the SMILES notation for 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione?
The canonical SMILES for 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione is Cc1c(Cl)oc2c1C(=O)N(C1CC1)C2=O.
What is the InChIKey of 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione?
The InChIKey is XPJPABQZOQQDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8ClNO3/c1-4-6-7(15-8(4)11)10(14)12(9(6)13)5-2-3-5/h5H,2-3H2,1H3.
What are the key properties of 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione?
2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione has a molecular weight of 225.63 g/mol, XLogP of 2.00, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-cyclopropyl-3-methylfuro[2,3-c]pyrrole-4,6-dione is sourced from PubChem (CID 149261834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).