2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone

C13H19NO2 — CID 43796327

IUPAC2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone
SMILESCCN(CC(=O)c1ccco1)C1CCCC1
InChIInChI=1S/C13H19NO2/c1-2-14(11-6-3-4-7-11)10-12(15)13-8-5-9-16-13/h5,8-9,11H,2-4,6-7,10H2,1H3
InChIKeyUOLFBFYSGFZCGP-UHFFFAOYSA-N
MW221.30 g/mol
LogP2.73
Rot. Bonds5

About 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone

2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone (PubChem CID 43796327) has the molecular formula C13H19NO2 and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone.

Molecular Properties

Compound Name2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone
PubChem CID43796327
Molecular FormulaC13H19NO2
Molecular Weight221.30 g/mol
Exact Mass221.14
IUPAC Name2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone
SMILESCCN(CC(=O)c1ccco1)C1CCCC1
InChIInChI=1S/C13H19NO2/c1-2-14(11-6-3-4-7-11)10-12(15)13-8-5-9-16-13/h5,8-9,11H,2-4,6-7,10H2,1H3
InChIKeyUOLFBFYSGFZCGP-UHFFFAOYSA-N
XLogP2.73
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone?
The IUPAC name of 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone (CID 43796327) is 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone.
What is the SMILES notation for 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone?
The canonical SMILES for 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone is CCN(CC(=O)c1ccco1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone?
The InChIKey is UOLFBFYSGFZCGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO2/c1-2-14(11-6-3-4-7-11)10-12(15)13-8-5-9-16-13/h5,8-9,11H,2-4,6-7,10H2,1H3.
What are the key properties of 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone?
2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone has a molecular weight of 221.30 g/mol, XLogP of 2.73, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone is sourced from PubChem (CID 43796327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).