N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide

C15H22N2O2 — CID 79720544

IUPACN-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide
SMILESCCN(CC1CCNCC1)C(=O)C=Cc1ccco1
InChIInChI=1S/C15H22N2O2/c1-2-17(12-13-7-9-16-10-8-13)15(18)6-5-14-4-3-11-19-14/h3-6,11,13,16H,2,7-10,12H2,1H3
InChIKeyHUSQYGZFCUMDQM-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.14
Rot. Bonds5

About N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide

N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide (PubChem CID 79720544) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide.

Molecular Properties

Compound NameN-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide
PubChem CID79720544
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide
SMILESCCN(CC1CCNCC1)C(=O)C=Cc1ccco1
InChIInChI=1S/C15H22N2O2/c1-2-17(12-13-7-9-16-10-8-13)15(18)6-5-14-4-3-11-19-14/h3-6,11,13,16H,2,7-10,12H2,1H3
InChIKeyHUSQYGZFCUMDQM-UHFFFAOYSA-N
XLogP2.14
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.14
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-ethyl-3-(4-fluorophenyl)-N-(piperidin-4-ylmethyl)prop-2-enamide
CID 79700451
N-ethyl-N-(piperidin-4-ylmethyl)furan-2-carboxamide
CID 79720984
(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide
CID 60806754
3-(4-chlorophenyl)-N-ethyl-N-(piperidin-4-ylmethyl)prop-2-enamide
CID 79700874
(E)-N-(cyclopropylmethyl)-3-(furan-2-yl)-N-prop-2-ynylprop-2-enamide
CID 115532594
3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide
CID 76923291
N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)furan-3-carboxamide
CID 79720319
(E)-3-(furan-2-yl)-N-methyl-N-(pyrrolidin-2-ylmethyl)prop-2-enamide
CID 106607941
(E)-3-(furan-2-yl)-N,N-bis(2-methylpropyl)prop-2-enamide
CID 6000305
(E)-N-ethyl-3-(furan-2-yl)-N-[2-oxo-2-(propan-2-ylamino)ethyl]prop-2-enamide
CID 18155626
N-ethyl-3-methyl-N-(piperidin-4-ylmethyl)but-2-enamide
CID 79721059
(E)-N-cyclopropyl-3-(furan-2-yl)-N-(pyrrolidin-2-ylmethyl)prop-2-enamide
CID 104974227

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide?
The IUPAC name of N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide (CID 79720544) is N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide.
What is the SMILES notation for N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide?
The canonical SMILES for N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide is CCN(CC1CCNCC1)C(=O)C=Cc1ccco1.
What is the InChIKey of N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide?
The InChIKey is HUSQYGZFCUMDQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-17(12-13-7-9-16-10-8-13)15(18)6-5-14-4-3-11-19-14/h3-6,11,13,16H,2,7-10,12H2,1H3.
What are the key properties of N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide?
N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide has a molecular weight of 262.35 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide is sourced from PubChem (CID 79720544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).