10-(1-benzofuran-3-yl)decan-1-amine

C18H27NO — CID 152675893

IUPAC10-(1-benzofuran-3-yl)decan-1-amine
SMILESNCCCCCCCCCCc1coc2ccccc12
InChIInChI=1S/C18H27NO/c19-14-10-6-4-2-1-3-5-7-11-16-15-20-18-13-9-8-12-17(16)18/h8-9,12-13,15H,1-7,10-11,14,19H2
InChIKeyZMMWRFZMRCKPGN-UHFFFAOYSA-N
MW273.42 g/mol
LogP5.05
Rot. Bonds10

About 10-(1-benzofuran-3-yl)decan-1-amine

10-(1-benzofuran-3-yl)decan-1-amine (PubChem CID 152675893) has the molecular formula C18H27NO and a molecular weight of 273.42 g/mol. Its IUPAC name is 10-(1-benzofuran-3-yl)decan-1-amine.

Molecular Properties

Compound Name10-(1-benzofuran-3-yl)decan-1-amine
PubChem CID152675893
Molecular FormulaC18H27NO
Molecular Weight273.42 g/mol
Exact Mass273.21
IUPAC Name10-(1-benzofuran-3-yl)decan-1-amine
SMILESNCCCCCCCCCCc1coc2ccccc12
InChIInChI=1S/C18H27NO/c19-14-10-6-4-2-1-3-5-7-11-16-15-20-18-13-9-8-12-17(16)18/h8-9,12-13,15H,1-7,10-11,14,19H2
InChIKeyZMMWRFZMRCKPGN-UHFFFAOYSA-N
XLogP5.05
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.42
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 10-(1-benzofuran-3-yl)decan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(6-methoxyhexyl)-1-benzofuran
CID 67274703
10-(1-benzofuran-3-yl)decane-1-sulfonic acid
CID 18415200
4-(1-benzofuran-3-yl)butane-1-sulfonic acid
CID 18415274
2-amino-6-(1-benzofuran-3-yl)hexanoic acid
CID 112518542
4-(1-benzofuran-3-yl)butanehydrazide
CID 116843663
3-(2-aminoethyl)chromen-4-one
CID 55212083
5-(1-benzofuran-3-yl)-N-methylpentanehydrazide
CID 116845280
8-naphthalen-1-yloctan-1-amine
CID 100987116
5-(4-methylnaphthalen-1-yl)pentan-1-amine
CID 65305159
N-[[4-(3-aminopropyl)phenyl]methyl]-N-[2-(1-benzofuran-3-yl)ethyl]pentan-1-amine
CID 70323492
4-[3-(4-azaniumylbutyl)-2-(1-benzofuran-3-ylmethyl)phenyl]butylazanium dichloride
CID 122129951
1-amino-3-(1-benzofuran-3-yl)propan-2-ol
CID 116859204

Frequently Asked Questions

What is the IUPAC name of 10-(1-benzofuran-3-yl)decan-1-amine?
The IUPAC name of 10-(1-benzofuran-3-yl)decan-1-amine (CID 152675893) is 10-(1-benzofuran-3-yl)decan-1-amine.
What is the SMILES notation for 10-(1-benzofuran-3-yl)decan-1-amine?
The canonical SMILES for 10-(1-benzofuran-3-yl)decan-1-amine is NCCCCCCCCCCc1coc2ccccc12.
What is the InChIKey of 10-(1-benzofuran-3-yl)decan-1-amine?
The InChIKey is ZMMWRFZMRCKPGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27NO/c19-14-10-6-4-2-1-3-5-7-11-16-15-20-18-13-9-8-12-17(16)18/h8-9,12-13,15H,1-7,10-11,14,19H2.
What are the key properties of 10-(1-benzofuran-3-yl)decan-1-amine?
10-(1-benzofuran-3-yl)decan-1-amine has a molecular weight of 273.42 g/mol, XLogP of 5.05, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(1-benzofuran-3-yl)decan-1-amine is sourced from PubChem (CID 152675893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).