6-(2-Aminopropyl)benzofuran

C11H13NO — CID 9794343

IUPAC1-(1-benzofuran-6-yl)propan-2-amine
SMILESCC(CC1=CC2=C(C=C1)C=CO2)N
InChIInChI=1S/C11H13NO/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-5,7-8H,6,12H2,1H3
InChIKeyFQDAMYLMQQKPRX-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.10
Rot. Bonds2

About 6-(2-Aminopropyl)benzofuran

6-(2-Aminopropyl)benzofuran (PubChem CID 9794343) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 1-(1-benzofuran-6-yl)propan-2-amine.

Molecular Properties

Compound Name6-(2-Aminopropyl)benzofuran
PubChem CID9794343
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name1-(1-benzofuran-6-yl)propan-2-amine
SMILESCC(CC1=CC2=C(C=C1)C=CO2)N
InChIInChI=1S/C11H13NO/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-5,7-8H,6,12H2,1H3
InChIKeyFQDAMYLMQQKPRX-UHFFFAOYSA-N
XLogP2.10
TPSA39.20 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity171

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-(2-Aminopropyl)benzofuran
CID 9837232
7,8,9,10-tetrahydro-6H-furo[2,3-i][3]benzazepine
CID 44451369
7,8,9,10-tetrahydro-6H-benzofuro[6,7-d]azepine
CID 44451373
2-Benzo[b]furan-3-ylethylamine
CID 12420812
1-(1-Benzofuran-2-yl)ethan-1-amine
CID 3164026
4-(2-Aminopropyl)benzofuran
CID 10130546
7-(2-Aminopropyl)benzofuran
CID 10130548
N-Ethyl-alpha-methyl-5-benzofuranethanamine
CID 102336590
1-(benzofuran-5-yl)-N-Methylpropan-2-aMine
CID 102336592
6-Mapb
CID 122202866
1-(1-benzofuran-5-yl)-N-methylpropan-2-amine;hydrochloride
CID 127263322
(2S)-1-(1-benzofuran-5-yl)-N-methylpropan-2-amine
CID 121493472

Frequently Asked Questions

What is the IUPAC name of 6-(2-Aminopropyl)benzofuran?
The IUPAC name of 6-(2-Aminopropyl)benzofuran (CID 9794343) is 1-(1-benzofuran-6-yl)propan-2-amine.
What is the SMILES notation for 6-(2-Aminopropyl)benzofuran?
The canonical SMILES for 6-(2-Aminopropyl)benzofuran is CC(CC1=CC2=C(C=C1)C=CO2)N.
What is the InChIKey of 6-(2-Aminopropyl)benzofuran?
The InChIKey is FQDAMYLMQQKPRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-8(12)6-9-2-3-10-4-5-13-11(10)7-9/h2-5,7-8H,6,12H2,1H3.
What are the key properties of 6-(2-Aminopropyl)benzofuran?
6-(2-Aminopropyl)benzofuran has a molecular weight of 175.23 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-Aminopropyl)benzofuran is sourced from PubChem (CID 9794343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).