N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine

C12H17NO2 — CID 63096218

IUPACN-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCNC1COc2cc(OC(C)C)ccc21
InChIInChI=1S/C12H17NO2/c1-8(2)15-9-4-5-10-11(13-3)7-14-12(10)6-9/h4-6,8,11,13H,7H2,1-3H3
InChIKeyMWOUBCAPQKXZND-UHFFFAOYSA-N
MW207.27 g/mol
LogP2.13
Rot. Bonds3

About N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine

N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 63096218) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound NameN-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine
PubChem CID63096218
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC NameN-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine
SMILESCNC1COc2cc(OC(C)C)ccc21
InChIInChI=1S/C12H17NO2/c1-8(2)15-9-4-5-10-11(13-3)7-14-12(10)6-9/h4-6,8,11,13H,7H2,1-3H3
InChIKeyMWOUBCAPQKXZND-UHFFFAOYSA-N
XLogP2.13
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-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

2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]propanenitrile
CID 63097438
6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-ol
CID 63096962
4-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]butan-2-ol
CID 113398857
N-methyl-6-propoxy-2,3-dihydro-1-benzofuran-3-amine
CID 63095165
6-(3,3-dimethylbutoxy)-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 63094976
4-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]butan-1-ol
CID 63096736
6-[3-(dimethylamino)propoxy]-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 114524835
2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide
CID 63095853
6-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 79982701
ethyl 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]acetate
CID 63094984
N-methyl-6-(2-methylidenebutoxy)-2,3-dihydro-1-benzofuran-3-amine
CID 66044717
N-methyl-6-pent-3-ynoxy-2,3-dihydro-1-benzofuran-3-amine
CID 104805129

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine (CID 63096218) is N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine is CNC1COc2cc(OC(C)C)ccc21.
What is the InChIKey of N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is MWOUBCAPQKXZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-8(2)15-9-4-5-10-11(13-3)7-14-12(10)6-9/h4-6,8,11,13H,7H2,1-3H3.
What are the key properties of N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine?
N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 207.27 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 63096218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).