N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine

C10H13NO — CID 45088771

IUPACN,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCN(C)C1COc2ccccc21
InChIInChI=1S/C10H13NO/c1-11(2)9-7-12-10-6-4-3-5-8(9)10/h3-6,9H,7H2,1-2H3
InChIKeyCSOWBVGQGSHXAB-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.68
Rot. Bonds1

About N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine

N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 45088771) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine
PubChem CID45088771
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC NameN,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCN(C)C1COc2ccccc21
InChIInChI=1S/C10H13NO/c1-11(2)9-7-12-10-6-4-3-5-8(9)10/h3-6,9H,7H2,1-2H3
InChIKeyCSOWBVGQGSHXAB-UHFFFAOYSA-N
XLogP1.68
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-ethyl-2,3-dihydro-1-benzofuran-3-amine
CID 90805957
2,3-dihydro-1-benzofuran-3-ol
CID 585896
3-iodo-2,3-dihydro-1-benzofuran
CID 154708354
(3R)-2,3-dihydro-1-benzofuran-3-amine
CID 40787193
(3S)-3-tert-butyl-2,3-dihydro-1-benzofuran
CID 129157836
(4S)-3-methyl-3,4-dihydro-2H-chromen-4-amine
CID 68776309
(3S)-2,3-dihydro-1-benzofuran-3-amine;hydrochloride
CID 119030525
3,4-dimethyl-3,4-dihydro-2H-chromene;methanol
CID 90924294
(1R)-1-[(3R)-2,3-dihydro-1-benzofuran-3-yl]ethanamine
CID 96839651
3-(dimethylsulfamoylamino)-2,3-dihydro-1-benzofuran
CID 110751655
5-methyl-2,3,4,5-tetrahydro-1-benzoxepin-3-amine
CID 142226246
bis(2,3-dihydro-1-benzofuran-3-yl)methanone
CID 174352835

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine (CID 45088771) is N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine is CN(C)C1COc2ccccc21.
What is the InChIKey of N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is CSOWBVGQGSHXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO/c1-11(2)9-7-12-10-6-4-3-5-8(9)10/h3-6,9H,7H2,1-2H3.
What are the key properties of N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine?
N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 163.22 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 45088771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).