(E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide

C12H16N2O2 — CID 9271007

IUPAC(E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide
SMILESO=C(/C=C/c1ccco1)NN1CCCCC1
InChIInChI=1S/C12H16N2O2/c15-12(7-6-11-5-4-10-16-11)13-14-8-2-1-3-9-14/h4-7,10H,1-3,8-9H2,(H,13,15)/b7-6+
InChIKeyDPMRBKXHKCGNSF-VOTSOKGWSA-N
MW220.27 g/mol
LogP1.81
Rot. Bonds3

About (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide

(E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide (PubChem CID 9271007) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide
PubChem CID9271007
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name(E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide
SMILESO=C(/C=C/c1ccco1)NN1CCCCC1
InChIInChI=1S/C12H16N2O2/c15-12(7-6-11-5-4-10-16-11)13-14-8-2-1-3-9-14/h4-7,10H,1-3,8-9H2,(H,13,15)/b7-6+
InChIKeyDPMRBKXHKCGNSF-VOTSOKGWSA-N
XLogP1.81
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(azepane-1-carbothioyl)-3-(furan-2-yl)prop-2-enamide
CID 762371
3-(furan-2-yl)-N-(1,2,4-triazol-4-yl)prop-2-enamide
CID 824100
3-(furan-2-yl)-N-[2-[3-(furan-2-yl)prop-2-enoylamino]cyclohexyl]prop-2-enamide
CID 3824750
(E)-N-cyclopropyl-3-(furan-2-yl)prop-2-enamide
CID 963880
N-(azetidin-3-yl)-3-(furan-2-yl)prop-2-enamide
CID 77114393
(E)-N-[2-(cycloheptylamino)ethyl]-3-(furan-2-yl)prop-2-enamide
CID 81483200
(E)-3-(furan-2-yl)-N-(hydroxymethyl)prop-2-enamide
CID 131239465
(E)-3-(furan-2-yl)-N-(1-phenylcyclobutyl)prop-2-enamide
CID 51273013
3-(furan-2-yl)-N-phenylprop-2-enamide
CID 578025
(E)-N-(5-chloro-2-pyrrolidin-1-ylphenyl)-3-(furan-2-yl)prop-2-enamide
CID 7406865
N-benzhydryl-3-(furan-2-yl)prop-2-enamide
CID 880414
(E)-3-(furan-2-yl)-N-(morpholine-4-carbothioyl)prop-2-enamide
CID 2054544

Frequently Asked Questions

What is the IUPAC name of (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide?
The IUPAC name of (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide (CID 9271007) is (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide.
What is the SMILES notation for (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide?
The canonical SMILES for (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide is O=C(/C=C/c1ccco1)NN1CCCCC1.
What is the InChIKey of (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide?
The InChIKey is DPMRBKXHKCGNSF-VOTSOKGWSA-N. The full InChI is InChI=1S/C12H16N2O2/c15-12(7-6-11-5-4-10-16-11)13-14-8-2-1-3-9-14/h4-7,10H,1-3,8-9H2,(H,13,15)/b7-6+.
What are the key properties of (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide?
(E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide has a molecular weight of 220.27 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(furan-2-yl)-N-piperidin-1-ylprop-2-enamide is sourced from PubChem (CID 9271007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).