3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine

C13H18N2O — CID 70110776

IUPAC3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine
SMILESNCCCN1CCc2ccc3c(c21)CCO3
InChIInChI=1S/C13H18N2O/c14-6-1-7-15-8-4-10-2-3-12-11(13(10)15)5-9-16-12/h2-3H,1,4-9,14H2
InChIKeyNKJBRHAMUPSHAN-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.33
Rot. Bonds3

About 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine

3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine (PubChem CID 70110776) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine
PubChem CID70110776
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine
SMILESNCCCN1CCc2ccc3c(c21)CCO3
InChIInChI=1S/C13H18N2O/c14-6-1-7-15-8-4-10-2-3-12-11(13(10)15)5-9-16-12/h2-3H,1,4-9,14H2
InChIKeyNKJBRHAMUPSHAN-UHFFFAOYSA-N
XLogP1.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine?
The IUPAC name of 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine (CID 70110776) is 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine.
What is the SMILES notation for 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine?
The canonical SMILES for 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine is NCCCN1CCc2ccc3c(c21)CCO3.
What is the InChIKey of 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine?
The InChIKey is NKJBRHAMUPSHAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c14-6-1-7-15-8-4-10-2-3-12-11(13(10)15)5-9-16-12/h2-3H,1,4-9,14H2.
What are the key properties of 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine?
3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine has a molecular weight of 218.30 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3,7,8-tetrahydrofuro[2,3-g]indol-1-yl)propan-1-amine is sourced from PubChem (CID 70110776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).