[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine

C15H15NO — CID 54910506

IUPAC[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine
SMILESNCc1cccc(-c2ccc3c(c2)CCO3)c1
InChIInChI=1S/C15H15NO/c16-10-11-2-1-3-12(8-11)13-4-5-15-14(9-13)6-7-17-15/h1-5,8-9H,6-7,10,16H2
InChIKeyMAMCTQMRJHUDGJ-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.75
Rot. Bonds2

About [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine

[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine (PubChem CID 54910506) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine
PubChem CID54910506
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine
SMILESNCc1cccc(-c2ccc3c(c2)CCO3)c1
InChIInChI=1S/C15H15NO/c16-10-11-2-1-3-12(8-11)13-4-5-15-14(9-13)6-7-17-15/h1-5,8-9H,6-7,10,16H2
InChIKeyMAMCTQMRJHUDGJ-UHFFFAOYSA-N
XLogP2.75
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine
CID 63021121
[4-[(2,3-dihydro-1-benzofuran-5-ylmethylamino)methyl]phenyl]methanamine
CID 115213219
[4-(aminomethyl)phenyl]-(2,3-dihydro-1-benzofuran-5-yl)methanamine
CID 116937080
[3-(5-methyl-2,3-dihydro-1-benzofuran-7-yl)phenyl]methanamine
CID 174553963
[3-(aminomethyl)phenyl]-(3,4-dihydro-2H-chromen-6-yl)methanamine
CID 116936978
2-[[3-(aminomethyl)benzoyl]-(2,3-dihydro-1-benzofuran-5-yl)amino]acetic acid
CID 22034284
[3-[6-[3-(aminomethyl)phenyl]-9H-fluoren-3-yl]phenyl]methanamine
CID 158799416
2-[3-(2,3-dihydro-1-benzofuran-6-yl)phenyl]acetic acid
CID 155498945
4-(2,3-dihydro-1-benzofuran-5-yl)-2-ethylaniline
CID 81287575
[2-(2,3-dihydro-1-benzofuran-5-yl)-1H-benzimidazol-4-yl]methanamine
CID 104721133
methyl 3-(2,3-dihydro-1-benzofuran-5-yl)benzoate
CID 4131960
6-[4-[4-(3,4-dihydro-2H-chromen-6-yl)phenyl]phenyl]-3,4-dihydro-2H-chromene
CID 71339532

Frequently Asked Questions

What is the IUPAC name of [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine?
The IUPAC name of [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine (CID 54910506) is [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine.
What is the SMILES notation for [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine?
The canonical SMILES for [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine is NCc1cccc(-c2ccc3c(c2)CCO3)c1.
What is the InChIKey of [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine?
The InChIKey is MAMCTQMRJHUDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c16-10-11-2-1-3-12(8-11)13-4-5-15-14(9-13)6-7-17-15/h1-5,8-9H,6-7,10,16H2.
What are the key properties of [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine?
[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine has a molecular weight of 225.29 g/mol, XLogP of 2.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine is sourced from PubChem (CID 54910506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).