6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine

C11H15NO — CID 57039214

IUPAC6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine
SMILESCOCc1ccc2c(c1)C(N)CC2
InChIInChI=1S/C11H15NO/c1-13-7-8-2-3-9-4-5-11(12)10(9)6-8/h2-3,6,11H,4-5,7,12H2,1H3
InChIKeyVKVPBHDHSKURIB-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.78
Rot. Bonds2

About 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine

6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 57039214) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine
PubChem CID57039214
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine
SMILESCOCc1ccc2c(c1)C(N)CC2
InChIInChI=1S/C11H15NO/c1-13-7-8-2-3-9-4-5-11(12)10(9)6-8/h2-3,6,11H,4-5,7,12H2,1H3
InChIKeyVKVPBHDHSKURIB-UHFFFAOYSA-N
XLogP1.78
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine (CID 57039214) is 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine is COCc1ccc2c(c1)C(N)CC2.
What is the InChIKey of 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is VKVPBHDHSKURIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-13-7-8-2-3-9-4-5-11(12)10(9)6-8/h2-3,6,11H,4-5,7,12H2,1H3.
What are the key properties of 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine?
6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 177.25 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 57039214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).