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

C15H15NO — CID 63021121

IUPAC[3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine
SMILESNCc1cccc(-c2ccc3c(c2)COC3)c1
InChIInChI=1S/C15H15NO/c16-8-11-2-1-3-12(6-11)13-4-5-14-9-17-10-15(14)7-13/h1-7H,8-10,16H2
InChIKeyOTRHRZPFUAOBOE-UHFFFAOYSA-N
MW225.29 g/mol
LogP2.84
Rot. Bonds2

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

[3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine (PubChem CID 63021121) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine.

Molecular Properties

Compound Name[3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine
PubChem CID63021121
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name[3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine
SMILESNCc1cccc(-c2ccc3c(c2)COC3)c1
InChIInChI=1S/C15H15NO/c16-8-11-2-1-3-12(6-11)13-4-5-14-9-17-10-15(14)7-13/h1-7H,8-10,16H2
InChIKeyOTRHRZPFUAOBOE-UHFFFAOYSA-N
XLogP2.84
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 ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,3-dihydro-2-benzofuran-5-ylmethanamine;hydrochloride
CID 47002851
[3-(5,6,7,8-tetrahydronaphthalen-2-yl)phenyl]methanamine
CID 61032630
3-(1,3-dihydro-2-benzofuran-5-yl)aniline
CID 63020601
[3-[6-[3-(aminomethyl)phenyl]-9H-fluoren-3-yl]phenyl]methanamine
CID 158799416
[3-(2,3-dihydro-1-benzofuran-5-yl)phenyl]methanamine
CID 54910506
[3-(4-methylphenyl)phenyl]methanamine
CID 1392243
[3-[4-(morpholin-4-ylmethyl)phenyl]phenyl]methanamine
CID 10891323
[4-[3-(morpholin-4-ylmethyl)phenyl]phenyl]methanamine
CID 39226421
[5-chloro-2-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine
CID 66155912
[3-(3-propylphenyl)phenyl]methanamine
CID 1392934
[3-[3-(methylaminomethyl)phenyl]phenyl]methanamine
CID 58788121
(3-pyridin-4-ylphenyl)methanamine;dihydrochloride
CID 23086760

Frequently Asked Questions

What is the IUPAC name of [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine?
The IUPAC name of [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine (CID 63021121) is [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine.
What is the SMILES notation for [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine?
The canonical SMILES for [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine is NCc1cccc(-c2ccc3c(c2)COC3)c1.
What is the InChIKey of [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine?
The InChIKey is OTRHRZPFUAOBOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO/c16-8-11-2-1-3-12(6-11)13-4-5-14-9-17-10-15(14)7-13/h1-7H,8-10,16H2.
What are the key properties of [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine?
[3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine has a molecular weight of 225.29 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(1,3-dihydro-2-benzofuran-5-yl)phenyl]methanamine is sourced from PubChem (CID 63021121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).