1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine

C13H23NO2 — CID 116715979

IUPAC1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccoc1)C(CC)OC
InChIInChI=1S/C13H23NO2/c1-4-7-14-12(13(5-2)15-3)9-11-6-8-16-10-11/h6,8,10,12-14H,4-5,7,9H2,1-3H3
InChIKeyGXVBVBRUOQMOIE-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.62
Rot. Bonds8

About 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine

1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine (PubChem CID 116715979) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine.

Molecular Properties

Compound Name1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine
PubChem CID116715979
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine
SMILESCCCNC(Cc1ccoc1)C(CC)OC
InChIInChI=1S/C13H23NO2/c1-4-7-14-12(13(5-2)15-3)9-11-6-8-16-10-11/h6,8,10,12-14H,4-5,7,9H2,1-3H3
InChIKeyGXVBVBRUOQMOIE-UHFFFAOYSA-N
XLogP2.62
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,5-difluorophenyl)-3-methoxy-N-propylpentan-2-amine
CID 105406993
1-(3-bromophenyl)-3-methoxy-N-propylpentan-2-amine
CID 116715984
N-[1-(furan-2-yl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 83175419
1-(2,3-difluorophenyl)-3-methoxy-N-propylpentan-2-amine
CID 116716158
1-(furan-3-yl)-3-methoxyhexan-2-amine
CID 116718509
1,1,1-trifluoro-3-(furan-3-yl)-N-propylpropan-2-amine
CID 105030039
3-methoxy-1-(1-pentan-3-ylpyrazol-3-yl)-N-propylpentan-2-amine
CID 116716177
N-[2-(furan-3-yl)-1-(1-methoxycyclobutyl)ethyl]propan-1-amine
CID 116714803
3-methoxy-N-propyl-1-(1,3-thiazol-5-yl)pentan-2-amine
CID 116716182
3-ethoxy-1-(furan-3-yl)-3-methyl-N-propylbutan-2-amine
CID 116727069
4-[3-methoxy-2-(propylamino)hexyl]pyridin-2-amine
CID 116719566
4-(furan-3-yl)-1-N,1-N-dimethyl-3-N-propylbutane-1,3-diamine
CID 83182973

Frequently Asked Questions

What is the IUPAC name of 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine?
The IUPAC name of 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine (CID 116715979) is 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine.
What is the SMILES notation for 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine?
The canonical SMILES for 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine is CCCNC(Cc1ccoc1)C(CC)OC.
What is the InChIKey of 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine?
The InChIKey is GXVBVBRUOQMOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-4-7-14-12(13(5-2)15-3)9-11-6-8-16-10-11/h6,8,10,12-14H,4-5,7,9H2,1-3H3.
What are the key properties of 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine?
1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine has a molecular weight of 225.33 g/mol, XLogP of 2.62, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-3-yl)-3-methoxy-N-propylpentan-2-amine is sourced from PubChem (CID 116715979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).