N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide

C20H23NO4 — CID 20886050

IUPACN-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide
SMILESCc1c(C(=O)NC2CCCC2)oc2ccc3c(c12)C(=O)CC(C)(C)O3
InChIInChI=1S/C20H23NO4/c1-11-16-14(24-18(11)19(23)21-12-6-4-5-7-12)8-9-15-17(16)13(22)10-20(2,3)25-15/h8-9,12H,4-7,10H2,1-3H3,(H,21,23)
InChIKeyDFTINWIEGMKSMH-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.16
Rot. Bonds2

About N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide

N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide (PubChem CID 20886050) has the molecular formula C20H23NO4 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide
PubChem CID20886050
Molecular FormulaC20H23NO4
Molecular Weight341.41 g/mol
Exact Mass341.16
IUPAC NameN-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide
SMILESCc1c(C(=O)NC2CCCC2)oc2ccc3c(c12)C(=O)CC(C)(C)O3
InChIInChI=1S/C20H23NO4/c1-11-16-14(24-18(11)19(23)21-12-6-4-5-7-12)8-9-15-17(16)13(22)10-20(2,3)25-15/h8-9,12H,4-7,10H2,1-3H3,(H,21,23)
InChIKeyDFTINWIEGMKSMH-UHFFFAOYSA-N
XLogP4.16
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide?
The IUPAC name of N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide (CID 20886050) is N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide?
The canonical SMILES for N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide is Cc1c(C(=O)NC2CCCC2)oc2ccc3c(c12)C(=O)CC(C)(C)O3.
What is the InChIKey of N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide?
The InChIKey is DFTINWIEGMKSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO4/c1-11-16-14(24-18(11)19(23)21-12-6-4-5-7-12)8-9-15-17(16)13(22)10-20(2,3)25-15/h8-9,12H,4-7,10H2,1-3H3,(H,21,23).
What are the key properties of N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide?
N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 4.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1,7,7-trimethyl-9-oxo-8H-furo[3,2-f]chromene-2-carboxamide is sourced from PubChem (CID 20886050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).