(E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide

C12H15NO2 — CID 2303075

IUPAC(E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide
SMILESO=C(/C=C/c1ccco1)NC1CCCC1
InChIInChI=1S/C12H15NO2/c14-12(13-10-4-1-2-5-10)8-7-11-6-3-9-15-11/h3,6-10H,1-2,4-5H2,(H,13,14)/b8-7+
InChIKeyFCCRHMLMVXSFJR-BQYQJAHWSA-N
MW205.26 g/mol
LogP2.35
Rot. Bonds3

About (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide

(E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide (PubChem CID 2303075) has the molecular formula C12H15NO2 and a molecular weight of 205.26 g/mol. Its IUPAC name is (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide.

Molecular Properties

Compound Name(E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide
PubChem CID2303075
Molecular FormulaC12H15NO2
Molecular Weight205.26 g/mol
Exact Mass205.11
IUPAC Name(E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide
SMILESO=C(/C=C/c1ccco1)NC1CCCC1
InChIInChI=1S/C12H15NO2/c14-12(13-10-4-1-2-5-10)8-7-11-6-3-9-15-11/h3,6-10H,1-2,4-5H2,(H,13,14)/b8-7+
InChIKeyFCCRHMLMVXSFJR-BQYQJAHWSA-N
XLogP2.35
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide?
The IUPAC name of (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide (CID 2303075) is (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide.
What is the SMILES notation for (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide?
The canonical SMILES for (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide is O=C(/C=C/c1ccco1)NC1CCCC1.
What is the InChIKey of (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide?
The InChIKey is FCCRHMLMVXSFJR-BQYQJAHWSA-N. The full InChI is InChI=1S/C12H15NO2/c14-12(13-10-4-1-2-5-10)8-7-11-6-3-9-15-11/h3,6-10H,1-2,4-5H2,(H,13,14)/b8-7+.
What are the key properties of (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide?
(E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide has a molecular weight of 205.26 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-cyclopentyl-3-(furan-2-yl)prop-2-enamide is sourced from PubChem (CID 2303075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).