3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide

C16H26N2O2 — CID 63134948

IUPAC3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
SMILESCCC1(C(=O)NC(C)CCc2ccco2)CCCNC1
InChIInChI=1S/C16H26N2O2/c1-3-16(9-5-10-17-12-16)15(19)18-13(2)7-8-14-6-4-11-20-14/h4,6,11,13,17H,3,5,7-10,12H2,1-2H3,(H,18,19)
InChIKeySTUKLXSTDFBCDM-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.50
Rot. Bonds6

About 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide

3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide (PubChem CID 63134948) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide.

Molecular Properties

Compound Name3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
PubChem CID63134948
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
SMILESCCC1(C(=O)NC(C)CCc2ccco2)CCCNC1
InChIInChI=1S/C16H26N2O2/c1-3-16(9-5-10-17-12-16)15(19)18-13(2)7-8-14-6-4-11-20-14/h4,6,11,13,17H,3,5,7-10,12H2,1-2H3,(H,18,19)
InChIKeySTUKLXSTDFBCDM-UHFFFAOYSA-N
XLogP2.50
TPSA54.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-N-[2-(furan-2-yl)ethyl]piperidine-3-carboxamide
CID 63130359
N-[4-(furan-2-yl)butan-2-yl]-2-methylpiperidine-2-carboxamide
CID 104596634
3-ethyl-N-(furan-2-ylmethyl)pyrrolidine-3-carboxamide
CID 63140952
1-cyano-N-[4-(furan-2-yl)butan-2-yl]cyclopentane-1-carboxamide
CID 60717527
3-ethyl-N-(1-phenylethyl)piperidine-3-carboxamide
CID 63132202
3-ethyl-N-(2-methyl-1-thiophen-2-ylpropyl)piperidine-3-carboxamide
CID 63130877
N-[(2S)-4-(furan-2-yl)butan-2-yl]-1-phenylcyclopropane-1-carboxamide
CID 95639214
(3S)-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide
CID 81141055
N-[1-(2-bromophenyl)ethyl]-3-ethylpiperidine-3-carboxamide
CID 63130128
1-ethyl-3-[4-(furan-2-yl)butan-2-yl]urea
CID 115571916
3-ethyl-N-[(5-methylfuran-2-yl)methyl]piperidine-3-carboxamide
CID 55167016
3-ethyl-N-(1-pyridin-4-ylethyl)piperidine-3-carboxamide
CID 63130581

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide?
The IUPAC name of 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide (CID 63134948) is 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide.
What is the SMILES notation for 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide?
The canonical SMILES for 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide is CCC1(C(=O)NC(C)CCc2ccco2)CCCNC1.
What is the InChIKey of 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide?
The InChIKey is STUKLXSTDFBCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-3-16(9-5-10-17-12-16)15(19)18-13(2)7-8-14-6-4-11-20-14/h4,6,11,13,17H,3,5,7-10,12H2,1-2H3,(H,18,19).
What are the key properties of 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide?
3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-[4-(furan-2-yl)butan-2-yl]piperidine-3-carboxamide is sourced from PubChem (CID 63134948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).