N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine

C10H15NO — CID 83905480

IUPACN,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine
SMILESCNC1CCCc2cc(C)oc21
InChIInChI=1S/C10H15NO/c1-7-6-8-4-3-5-9(11-2)10(8)12-7/h6,9,11H,3-5H2,1-2H3
InChIKeyOUDNGZPCXWGSGC-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.18
Rot. Bonds1

About N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine

N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine (PubChem CID 83905480) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine.

Molecular Properties

Compound NameN,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine
PubChem CID83905480
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine
SMILESCNC1CCCc2cc(C)oc21
InChIInChI=1S/C10H15NO/c1-7-6-8-4-3-5-9(11-2)10(8)12-7/h6,9,11H,3-5H2,1-2H3
InChIKeyOUDNGZPCXWGSGC-UHFFFAOYSA-N
XLogP2.18
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine?
The IUPAC name of N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine (CID 83905480) is N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine.
What is the SMILES notation for N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine?
The canonical SMILES for N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine is CNC1CCCc2cc(C)oc21.
What is the InChIKey of N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine?
The InChIKey is OUDNGZPCXWGSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-7-6-8-4-3-5-9(11-2)10(8)12-7/h6,9,11H,3-5H2,1-2H3.
What are the key properties of N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine?
N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine has a molecular weight of 165.24 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-4,5,6,7-tetrahydro-1-benzofuran-7-amine is sourced from PubChem (CID 83905480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).