4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine

C17H19NO2 — CID 65419418

IUPAC4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine
SMILESCOc1ccccc1CC1(N)CCOc2ccccc21
InChIInChI=1S/C17H19NO2/c1-19-15-8-4-2-6-13(15)12-17(18)10-11-20-16-9-5-3-7-14(16)17/h2-9H,10-12,18H2,1H3
InChIKeyMEZGFCOFDIPVRF-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.87
Rot. Bonds3

About 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine

4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine (PubChem CID 65419418) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine.

Molecular Properties

Compound Name4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine
PubChem CID65419418
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine
SMILESCOc1ccccc1CC1(N)CCOc2ccccc21
InChIInChI=1S/C17H19NO2/c1-19-15-8-4-2-6-13(15)12-17(18)10-11-20-16-9-5-3-7-14(16)17/h2-9H,10-12,18H2,1H3
InChIKeyMEZGFCOFDIPVRF-UHFFFAOYSA-N
XLogP2.87
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-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

4-[(2,5-dimethylphenyl)methyl]-2,3-dihydrochromen-4-amine
CID 65403944
4-[(2-bromo-4-fluorophenyl)methyl]-2,3-dihydrochromen-4-amine
CID 65403950
1-[(2-methoxyphenyl)methyl]-4-methyl-3,4-dihydro-2H-naphthalen-1-amine
CID 115419799
4-[(5-ethylthiophen-2-yl)methyl]-2,3-dihydrochromen-4-amine
CID 65406283
4-[(5-chlorothiophen-2-yl)methyl]-2,3-dihydrochromen-4-amine
CID 65421588
4-(4,4-dimethylpentyl)-2,3-dihydrochromen-4-amine
CID 114210547
4-ethyl-8-methoxy-2,3-dihydrochromen-4-amine
CID 82194434
1-[(2-methoxyphenyl)methyl]-2,2-dimethylcyclohexan-1-amine
CID 79834373
[1-[(2-methoxyphenyl)methyl]cyclopentyl]methanamine
CID 62725891
[3-[(2-methoxyphenyl)methyl]-2-methyloxolan-3-yl]methanamine
CID 114533952
[3-[(2-methoxyphenyl)methyl]oxolan-3-yl]methanol
CID 66058999
3-[(2-methoxyphenyl)methyl]-2,4-dihydrochromene-3-carbonitrile
CID 65408987

Frequently Asked Questions

What is the IUPAC name of 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine?
The IUPAC name of 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine (CID 65419418) is 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine.
What is the SMILES notation for 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine?
The canonical SMILES for 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine is COc1ccccc1CC1(N)CCOc2ccccc21.
What is the InChIKey of 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine?
The InChIKey is MEZGFCOFDIPVRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-19-15-8-4-2-6-13(15)12-17(18)10-11-20-16-9-5-3-7-14(16)17/h2-9H,10-12,18H2,1H3.
What are the key properties of 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine?
4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine has a molecular weight of 269.34 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-methoxyphenyl)methyl]-2,3-dihydrochromen-4-amine is sourced from PubChem (CID 65419418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).