N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide

C19H24N2O3 — CID 50974230

IUPACN,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide
SMILESC=CCN(Cc1ccco1)C(=O)C1CCN(Cc2ccco2)CC1
InChIInChI=1S/C19H24N2O3/c1-2-9-21(15-18-6-4-13-24-18)19(22)16-7-10-20(11-8-16)14-17-5-3-12-23-17/h2-6,12-13,16H,1,7-11,14-15H2
InChIKeyOZGAUJJTMQNPMG-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.30
Rot. Bonds7

About N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide

N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide (PubChem CID 50974230) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide
PubChem CID50974230
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC NameN,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide
SMILESC=CCN(Cc1ccco1)C(=O)C1CCN(Cc2ccco2)CC1
InChIInChI=1S/C19H24N2O3/c1-2-9-21(15-18-6-4-13-24-18)19(22)16-7-10-20(11-8-16)14-17-5-3-12-23-17/h2-6,12-13,16H,1,7-11,14-15H2
InChIKeyOZGAUJJTMQNPMG-UHFFFAOYSA-N
XLogP3.30
TPSA49.83 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-N-prop-2-enylcyclobutanecarboxamide
CID 4611642
1-[(3-chlorophenyl)methyl]-N,N-bis(prop-2-enyl)piperidine-4-carboxamide
CID 1096606
N-(furan-2-ylmethyl)-N-(2-hydroxyethyl)-1-(oxan-4-yl)piperidine-4-carboxamide
CID 74234608
3-[cyclopropanecarbonyl(furan-2-ylmethyl)amino]propanoic acid
CID 82323935
(3S)-N,N-diethyl-1-(furan-2-ylmethyl)piperidine-3-carboxamide
CID 764291
N-benzyl-N-(furan-2-ylmethyl)cyclopentanecarboxamide
CID 52894765
1-(furan-2-ylmethyl)-1-prop-2-enylthiourea
CID 172640364
1-(furan-2-ylmethyl)-N,N-dimethylpiperidin-4-amine
CID 91664788
[(2S,6S)-2,6-dimethylmorpholin-4-yl]-[1-(furan-2-ylmethyl)piperidin-4-yl]methanone
CID 97147422
N,N-bis(furan-2-ylmethyl)-1-(oxan-4-yl)piperidine-3-carboxamide
CID 74247687
1-(4-bromobenzoyl)-N-(furan-2-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 55437870
[1-(furan-2-ylmethyl)piperidin-4-yl]-[(4R)-4-hydroxy-1,2-oxazolidin-2-yl]methanone
CID 97140501

Frequently Asked Questions

What is the IUPAC name of N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide?
The IUPAC name of N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide (CID 50974230) is N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide.
What is the SMILES notation for N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide?
The canonical SMILES for N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide is C=CCN(Cc1ccco1)C(=O)C1CCN(Cc2ccco2)CC1.
What is the InChIKey of N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide?
The InChIKey is OZGAUJJTMQNPMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-2-9-21(15-18-6-4-13-24-18)19(22)16-7-10-20(11-8-16)14-17-5-3-12-23-17/h2-6,12-13,16H,1,7-11,14-15H2.
What are the key properties of N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide?
N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide has a molecular weight of 328.41 g/mol, XLogP of 3.30, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-bis(furan-2-ylmethyl)-N-prop-2-enylpiperidine-4-carboxamide is sourced from PubChem (CID 50974230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).