N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine

C13H21NO2 — CID 103987352

IUPACN-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine
SMILESCCNC(Cc1ccco1)CC1CCOC1
InChIInChI=1S/C13H21NO2/c1-2-14-12(8-11-5-7-15-10-11)9-13-4-3-6-16-13/h3-4,6,11-12,14H,2,5,7-10H2,1H3
InChIKeyMYLNQRXRGUWHBD-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.23
Rot. Bonds6

About N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine

N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine (PubChem CID 103987352) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine
PubChem CID103987352
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine
SMILESCCNC(Cc1ccco1)CC1CCOC1
InChIInChI=1S/C13H21NO2/c1-2-14-12(8-11-5-7-15-10-11)9-13-4-3-6-16-13/h3-4,6,11-12,14H,2,5,7-10H2,1H3
InChIKeyMYLNQRXRGUWHBD-UHFFFAOYSA-N
XLogP2.23
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(oxolan-3-yl)-3-phenylpropan-2-amine
CID 103987146
1-(furan-2-yl)-N-(oxolan-3-ylmethyl)propan-2-amine
CID 43693110
1-cycloheptyl-3-(furan-2-yl)-N-propylpropan-2-amine
CID 105029141
N-[1-(furan-2-yl)-2-(oxolan-3-yl)ethyl]propan-1-amine
CID 103987494
4-[2-(ethylamino)-3-(oxolan-3-yl)propyl]pyridin-2-amine
CID 103987201
1-cyclopentyl-N-ethyl-3-(oxolan-3-yl)propan-2-amine
CID 103987304
1-cyclopentyl-N-ethyl-4-(furan-2-yl)butan-2-amine
CID 105138868
1-(4-chloro-2-fluorophenyl)-N-ethyl-3-(oxolan-3-yl)propan-2-amine
CID 114856904
N-ethyl-1-(1-methylpyrazol-4-yl)-3-(oxolan-3-yl)propan-2-amine
CID 113362176
1-(3-bromo-4-fluorophenyl)-N-ethyl-3-(oxolan-3-yl)propan-2-amine
CID 103987220
N-ethyl-4-methyl-1-(oxolan-3-yl)hexan-2-amine
CID 103987176
N-ethyl-1-(oxolan-3-yl)decan-2-amine
CID 103987183

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine?
The IUPAC name of N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine (CID 103987352) is N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine.
What is the SMILES notation for N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine?
The canonical SMILES for N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine is CCNC(Cc1ccco1)CC1CCOC1.
What is the InChIKey of N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine?
The InChIKey is MYLNQRXRGUWHBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-14-12(8-11-5-7-15-10-11)9-13-4-3-6-16-13/h3-4,6,11-12,14H,2,5,7-10H2,1H3.
What are the key properties of N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine?
N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine has a molecular weight of 223.32 g/mol, XLogP of 2.23, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(furan-2-yl)-3-(oxolan-3-yl)propan-2-amine is sourced from PubChem (CID 103987352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).