1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine

C14H23NO2 — CID 65156343

IUPAC1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
SMILESCCCNC(CCC1CCCO1)c1ccco1
InChIInChI=1S/C14H23NO2/c1-2-9-15-13(14-6-4-11-17-14)8-7-12-5-3-10-16-12/h4,6,11-13,15H,2-3,5,7-10H2,1H3
InChIKeyNXUJWQMGSIUBHP-UHFFFAOYSA-N
MW237.34 g/mol
LogP3.28
Rot. Bonds7

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

1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine (PubChem CID 65156343) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine.

Molecular Properties

Compound Name1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
PubChem CID65156343
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
SMILESCCCNC(CCC1CCCO1)c1ccco1
InChIInChI=1S/C14H23NO2/c1-2-9-15-13(14-6-4-11-17-14)8-7-12-5-3-10-16-12/h4,6,11-13,15H,2-3,5,7-10H2,1H3
InChIKeyNXUJWQMGSIUBHP-UHFFFAOYSA-N
XLogP3.28
TPSA34.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-methylfuran-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 65156495
1-(3-bromofuran-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 115861250
1-(3,4-dimethylphenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 65156280
3-(oxolan-2-yl)-N-propyl-1-(4-propylphenyl)propan-1-amine
CID 65156384
1-(3-ethylphenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 105018462
3-(oxolan-2-yl)-N-propyl-1-thiophen-3-ylpropan-1-amine
CID 65166768
3-(oxolan-2-yl)-N-propyl-1-(2,3,4-trifluorophenyl)propan-1-amine
CID 115855107
1-(3-methoxyphenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 65167020
1-(3,5-dichlorophenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 104993774
1-(3-bromo-4-methylphenyl)-3-(oxolan-2-yl)-N-propylpropan-1-amine
CID 104993778
1-(furan-2-yl)-N-[3-(oxolan-2-ylmethoxy)propyl]propan-1-amine
CID 62632149
[1-(furan-2-yl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198479

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine?
The IUPAC name of 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine (CID 65156343) is 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine.
What is the SMILES notation for 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine?
The canonical SMILES for 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine is CCCNC(CCC1CCCO1)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine?
The InChIKey is NXUJWQMGSIUBHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-2-9-15-13(14-6-4-11-17-14)8-7-12-5-3-10-16-12/h4,6,11-13,15H,2-3,5,7-10H2,1H3.
What are the key properties of 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine?
1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine has a molecular weight of 237.34 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-3-(oxolan-2-yl)-N-propylpropan-1-amine is sourced from PubChem (CID 65156343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).