(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide

C15H22N2O2 — CID 60806754

IUPAC(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide
SMILESCCCN(C(=O)/C=C/c1ccco1)C1CCNCC1
InChIInChI=1S/C15H22N2O2/c1-2-11-17(13-7-9-16-10-8-13)15(18)6-5-14-4-3-12-19-14/h3-6,12-13,16H,2,7-11H2,1H3/b6-5+
InChIKeyNXRVHMCEGXSHGO-AATRIKPKSA-N
MW262.35 g/mol
LogP2.28
Rot. Bonds5

About (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide

(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide (PubChem CID 60806754) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide.

Molecular Properties

Compound Name(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide
PubChem CID60806754
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide
SMILESCCCN(C(=O)/C=C/c1ccco1)C1CCNCC1
InChIInChI=1S/C15H22N2O2/c1-2-11-17(13-7-9-16-10-8-13)15(18)6-5-14-4-3-12-19-14/h3-6,12-13,16H,2,7-11H2,1H3/b6-5+
InChIKeyNXRVHMCEGXSHGO-AATRIKPKSA-N
XLogP2.28
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 ≤ 52.28
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-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide
CID 79720544
(E)-N-[2-(dimethylamino)ethyl]-3-(furan-2-yl)-N-(oxan-4-yl)prop-2-enamide
CID 90606971
N-butyl-N-(1,1-dioxothiolan-3-yl)-3-(furan-2-yl)prop-2-enamide
CID 102603881
3-[cyclohexyl-[(E)-3-(furan-2-yl)prop-2-enoyl]amino]propanoic acid
CID 82326281
(E)-N-cyclopropyl-3-(furan-2-yl)-N-(pyrrolidin-2-ylmethyl)prop-2-enamide
CID 104974227
(2E,4E)-N-piperidin-4-yl-N-propylhexa-2,4-dienamide
CID 54923443
2-[3-(furan-2-yl)prop-2-enoyl-(oxan-4-yl)amino]acetic acid
CID 126772951
(E)-3-(4-propan-2-ylphenyl)-N-propyl-N-pyrrolidin-3-ylprop-2-enamide
CID 82177259
3-(furan-2-yl)-N-(piperidin-4-ylmethyl)prop-2-enamide
CID 76923291
N-cyclopropyl-3-(furan-2-yl)-N-(3-methylpentan-2-yl)prop-2-enamide
CID 72687598
3-phenyl-N-piperidin-3-yl-N-propylprop-2-enamide
CID 77002821
(E)-3-(furan-2-yl)-N,N-dimethylprop-2-enamide
CID 11480633

Frequently Asked Questions

What is the IUPAC name of (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide?
The IUPAC name of (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide (CID 60806754) is (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide.
What is the SMILES notation for (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide?
The canonical SMILES for (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide is CCCN(C(=O)/C=C/c1ccco1)C1CCNCC1.
What is the InChIKey of (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide?
The InChIKey is NXRVHMCEGXSHGO-AATRIKPKSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-11-17(13-7-9-16-10-8-13)15(18)6-5-14-4-3-12-19-14/h3-6,12-13,16H,2,7-11H2,1H3/b6-5+.
What are the key properties of (E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide?
(E)-3-(furan-2-yl)-N-piperidin-4-yl-N-propylprop-2-enamide has a molecular weight of 262.35 g/mol, XLogP of 2.28, 5 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-4-yl-N-propylprop-2-enamide is sourced from PubChem (CID 60806754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).