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

C13H21NO2 — CID 83175448

IUPACN-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1ccoc1)C1CCOC1
InChIInChI=1S/C13H21NO2/c1-2-5-14-13(12-4-7-16-10-12)8-11-3-6-15-9-11/h3,6,9,12-14H,2,4-5,7-8,10H2,1H3
InChIKeyPLFOCFINZQGDMN-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.23
Rot. Bonds6

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

N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine (PubChem CID 83175448) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine.

Molecular Properties

Compound NameN-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine
PubChem CID83175448
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC NameN-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine
SMILESCCCNC(Cc1ccoc1)C1CCOC1
InChIInChI=1S/C13H21NO2/c1-2-5-14-13(12-4-7-16-10-12)8-11-3-6-15-9-11/h3,6,9,12-14H,2,4-5,7-8,10H2,1H3
InChIKeyPLFOCFINZQGDMN-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-[2-(furan-3-yl)-1-(oxan-4-yl)ethyl]propan-1-amine
CID 83175844
N-[2-(4-ethylphenyl)-1-(oxolan-3-yl)ethyl]propan-1-amine
CID 65330199
N-[2-(furan-3-yl)-1-(thiolan-3-yl)ethyl]propan-1-amine
CID 105177672
N-[2-(5-bromothiophen-2-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine
CID 65330697
N-[2-(4-chlorophenyl)-1-(oxan-4-yl)ethyl]propan-1-amine
CID 62906214
N-[2-(4-iodophenyl)-1-(oxan-4-yl)ethyl]propan-1-amine
CID 65479183
N-[2-(furan-3-yl)-1-(1,4-oxathian-2-yl)ethyl]propan-1-amine
CID 83182561
N-[1-(5,6-dimethyl-1,4-dithian-2-yl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 103346410
1-[2-(oxolan-3-yl)-2-(propylamino)ethyl]pyridin-4-one
CID 104747569
3-[2-(oxolan-3-yl)-2-(propylamino)ethyl]pyridin-4-amine
CID 65329161
N-[1-(oxan-4-yl)-2-thiophen-3-ylethyl]propan-1-amine
CID 62907430
3-(furan-2-yl)-1-(oxolan-3-yl)-N-propylpropan-1-amine
CID 105147712

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine?
The IUPAC name of N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine (CID 83175448) is N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine.
What is the SMILES notation for N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine?
The canonical SMILES for N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine is CCCNC(Cc1ccoc1)C1CCOC1.
What is the InChIKey of N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine?
The InChIKey is PLFOCFINZQGDMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-2-5-14-13(12-4-7-16-10-12)8-11-3-6-15-9-11/h3,6,9,12-14H,2,4-5,7-8,10H2,1H3.
What are the key properties of N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine?
N-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-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-[2-(furan-3-yl)-1-(oxolan-3-yl)ethyl]propan-1-amine is sourced from PubChem (CID 83175448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).