N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine

C18H21NO — CID 79366302

IUPACN-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1ccc2c(c1)C(Nc1cc(C)ccc1C)CC2
InChIInChI=1S/C18H21NO/c1-12-4-5-13(2)18(10-12)19-17-9-7-14-6-8-15(20-3)11-16(14)17/h4-6,8,10-11,17,19H,7,9H2,1-3H3
InChIKeyFQQZMJVHUGSWBX-UHFFFAOYSA-N
MW267.37 g/mol
LogP4.41
Rot. Bonds3

About N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine

N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine (PubChem CID 79366302) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
PubChem CID79366302
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC NameN-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
SMILESCOc1ccc2c(c1)C(Nc1cc(C)ccc1C)CC2
InChIInChI=1S/C18H21NO/c1-12-4-5-13(2)18(10-12)19-17-9-7-14-6-8-15(20-3)11-16(14)17/h4-6,8,10-11,17,19H,7,9H2,1-3H3
InChIKeyFQQZMJVHUGSWBX-UHFFFAOYSA-N
XLogP4.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-5-methylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 82762030
N-(5-chloro-2-methylphenyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79230733
N-(2-bromo-4-methylphenyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79231811
N-(2-fluoro-4-methylphenyl)-7-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79233981
N-(4-bromo-3,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 107572282
N-(2-chlorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79366654
N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2-methylpyridin-3-amine
CID 79367060
2-[(6-methoxy-2,3-dihydro-1H-inden-1-yl)amino]-6-methylbenzonitrile
CID 107803670
N-(4-fluoro-2-methoxyphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79370032
N-(5-bromo-2,4-difluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 102852883
2-methoxy-N-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyridin-3-amine
CID 79366034
N-(2-chloro-4-fluorophenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79367032

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine (CID 79366302) is N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine is COc1ccc2c(c1)C(Nc1cc(C)ccc1C)CC2.
What is the InChIKey of N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
The InChIKey is FQQZMJVHUGSWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-12-4-5-13(2)18(10-12)19-17-9-7-14-6-8-15(20-3)11-16(14)17/h4-6,8,10-11,17,19H,7,9H2,1-3H3.
What are the key properties of N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine?
N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine has a molecular weight of 267.37 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-6-methoxy-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 79366302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).