4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol

C17H19NO2 — CID 115715635

IUPAC4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol
SMILESCOc1ccc2c(c1)C(NCc1ccc(O)cc1)CC2
InChIInChI=1S/C17H19NO2/c1-20-15-8-4-13-5-9-17(16(13)10-15)18-11-12-2-6-14(19)7-3-12/h2-4,6-8,10,17-19H,5,9,11H2,1H3
InChIKeyZSMIKVWFENHUNP-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.18
Rot. Bonds4

About 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol

4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol (PubChem CID 115715635) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol.

Molecular Properties

Compound Name4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol
PubChem CID115715635
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol
SMILESCOc1ccc2c(c1)C(NCc1ccc(O)cc1)CC2
InChIInChI=1S/C17H19NO2/c1-20-15-8-4-13-5-9-17(16(13)10-15)18-11-12-2-6-14(19)7-3-12/h2-4,6-8,10,17-19H,5,9,11H2,1H3
InChIKeyZSMIKVWFENHUNP-UHFFFAOYSA-N
XLogP3.18
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol 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

N-[(4-fluorophenyl)methyl]-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79366842
N-[(3-chloro-4-fluorophenyl)methyl]-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79370048
N-benzyl-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79240006
1-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]-4-methylcyclohexan-1-ol
CID 79370226
2,2-difluoro-3-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]propan-1-ol
CID 113463329
4-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]butan-1-ol
CID 106840756
N-[(2,5-difluorophenyl)methyl]-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79370217
ethane;(1R)-6-methoxy-N-prop-2-ynyl-2,3-dihydro-1H-inden-1-amine
CID 144639263
6-methoxy-N-(1,2-oxazol-3-ylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 81171529
3-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]-2-methylpropane-1,2-diol
CID 79366778
4-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]butanamide
CID 79366946
N-(furan-3-ylmethyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115674094

Frequently Asked Questions

What is the IUPAC name of 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol?
The IUPAC name of 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol (CID 115715635) is 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol.
What is the SMILES notation for 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol?
The canonical SMILES for 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol is COc1ccc2c(c1)C(NCc1ccc(O)cc1)CC2.
What is the InChIKey of 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol?
The InChIKey is ZSMIKVWFENHUNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-20-15-8-4-13-5-9-17(16(13)10-15)18-11-12-2-6-14(19)7-3-12/h2-4,6-8,10,17-19H,5,9,11H2,1H3.
What are the key properties of 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol?
4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol has a molecular weight of 269.34 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]methyl]phenol is sourced from PubChem (CID 115715635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).