1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine

C14H19NO2 — CID 10466517

IUPAC1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine
SMILESCc1c2c(c(CC(C)N)c3c1CCO3)OCC2
InChIInChI=1S/C14H19NO2/c1-8(15)7-12-13-10(3-5-16-13)9(2)11-4-6-17-14(11)12/h8H,3-7,15H2,1-2H3
InChIKeyPSEDSSOSMWPGTN-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.75
Rot. Bonds2

About 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine

1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine (PubChem CID 10466517) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine.

Molecular Properties

Compound Name1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine
PubChem CID10466517
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine
SMILESCc1c2c(c(CC(C)N)c3c1CCO3)OCC2
InChIInChI=1S/C14H19NO2/c1-8(15)7-12-13-10(3-5-16-13)9(2)11-4-6-17-14(11)12/h8H,3-7,15H2,1-2H3
InChIKeyPSEDSSOSMWPGTN-UHFFFAOYSA-N
XLogP1.75
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine with MolForge

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Related Compounds

(2R)-1-[4-(methoxymethyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-8-yl]propan-2-amine
CID 16747713
[8-[(2R)-2-aminopropyl]-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl]methanol
CID 44431687
(2R)-1-[4-(2-methoxyethoxymethyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-8-yl]propan-2-amine
CID 44431688
(2R)-1-[4-(trifluoromethyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-8-yl]propan-2-amine;hydrochloride
CID 49795905
2-(8-Methoxy-2,3,5,6-tetrahydro-benzo[1,2-b;5,4-b'']difuran-4-yl)-ethylamine
CID 10609802
1-(2,3,6,7-Tetrahydrofuro[2,3-f][1]benzofuran-4-yl)propan-2-amine
CID 10608911
(2S)-1-[4-(trifluoromethyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-8-yl]propan-2-amine;hydrochloride
CID 49795908
(2R)-1-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)propan-2-amine;hydrochloride
CID 49795909
(2S)-1-(2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)propan-2-amine;hydrochloride
CID 49795910
1-(8-Methyl-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-4-yl)propan-2-amine
CID 10657297
2-(8-Ethyl-2,3,6,7-tetrahydrobenzo[1,2-b:4,5-b']difuran-4-yl)ethanamine
CID 162430105
2-[4-(2-Fluoroethyl)-2,3,6,7-tetrahydrofuro[2,3-f][1]benzofuran-8-yl]ethanamine
CID 162430129

Frequently Asked Questions

What is the IUPAC name of 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine?
The IUPAC name of 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine (CID 10466517) is 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine.
What is the SMILES notation for 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine?
The canonical SMILES for 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine is Cc1c2c(c(CC(C)N)c3c1CCO3)OCC2.
What is the InChIKey of 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine?
The InChIKey is PSEDSSOSMWPGTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-8(15)7-12-13-10(3-5-16-13)9(2)11-4-6-17-14(11)12/h8H,3-7,15H2,1-2H3.
What are the key properties of 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine?
1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine has a molecular weight of 233.31 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methyl-2,3,5,6-tetrahydrofuro[3,2-f][1]benzofuran-8-yl)propan-2-amine is sourced from PubChem (CID 10466517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).