1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide

C23H29N3O2 — CID 53117852

IUPAC1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
SMILESCCn1cc(CN2CCC(C(=O)NCCc3ccco3)CC2)c2ccccc21
InChIInChI=1S/C23H29N3O2/c1-2-26-17-19(21-7-3-4-8-22(21)26)16-25-13-10-18(11-14-25)23(27)24-12-9-20-6-5-15-28-20/h3-8,15,17-18H,2,9-14,16H2,1H3,(H,24,27)
InChIKeyJHDFTOPZYFPOEL-UHFFFAOYSA-N
MW379.50 g/mol
LogP3.83
Rot. Bonds7

About 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide

1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide (PubChem CID 53117852) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
PubChem CID53117852
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC Name1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
SMILESCCn1cc(CN2CCC(C(=O)NCCc3ccco3)CC2)c2ccccc21
InChIInChI=1S/C23H29N3O2/c1-2-26-17-19(21-7-3-4-8-22(21)26)16-25-13-10-18(11-14-25)23(27)24-12-9-20-6-5-15-28-20/h3-8,15,17-18H,2,9-14,16H2,1H3,(H,24,27)
InChIKeyJHDFTOPZYFPOEL-UHFFFAOYSA-N
XLogP3.83
TPSA50.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(5-chloro-1-methylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 53117839
1-acetyl-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 110745476
1-[(1-ethyl-5-methoxyindol-3-yl)methyl]-N-(3-phenylpropyl)piperidine-4-carboxamide
CID 53117767
N-[2-(furan-2-yl)ethyl]cyclopentanecarboxamide
CID 110733508
N-[2-(4,6-dimethylpyrimidin-2-yl)ethyl]-1-(furan-2-ylmethyl)piperidine-4-carboxamide
CID 91775679
1-(benzenesulfonyl)-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 17442188
1-[1-[(1-ethylindol-3-yl)methyl]piperidin-4-yl]ethanamine
CID 63596895
N-[(2-ethoxyphenyl)methyl]-1-[(1-ethyl-5-methoxyindol-3-yl)methyl]piperidine-4-carboxamide
CID 53117776
1-[(1-ethyl-5-methoxyindol-3-yl)methyl]-N-[(2R)-2-phenylpropyl]piperidine-4-carboxamide
CID 95088469
N-[2-(furan-2-ylmethylsulfanyl)ethyl]-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 45006705
1-(4-benzyl-3-oxoquinoxalin-2-yl)-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide
CID 53062480
N-[2-[cyclohexyl(methyl)amino]ethyl]-1-[(1-ethyl-5-methoxyindol-3-yl)methyl]piperidine-4-carboxamide
CID 20974080

Frequently Asked Questions

What is the IUPAC name of 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide (CID 53117852) is 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide is CCn1cc(CN2CCC(C(=O)NCCc3ccco3)CC2)c2ccccc21.
What is the InChIKey of 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is JHDFTOPZYFPOEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-2-26-17-19(21-7-3-4-8-22(21)26)16-25-13-10-18(11-14-25)23(27)24-12-9-20-6-5-15-28-20/h3-8,15,17-18H,2,9-14,16H2,1H3,(H,24,27).
What are the key properties of 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide?
1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 379.50 g/mol, XLogP of 3.83, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1-ethylindol-3-yl)methyl]-N-[2-(furan-2-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 53117852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).