2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride

C11H16ClNO — CID 53407628

IUPAC2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride
SMILESCOCC1(N)Cc2ccccc2C1.Cl
InChIInChI=1S/C11H15NO.ClH/c1-13-8-11(12)6-9-4-2-3-5-10(9)7-11;/h2-5H,6-8,12H2,1H3;1H
InChIKeyUQBRDILFRIXTBN-UHFFFAOYSA-N
MW213.71 g/mol
LogP1.55
Rot. Bonds2

About 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride

2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride (PubChem CID 53407628) has the molecular formula C11H16ClNO and a molecular weight of 213.71 g/mol. Its IUPAC name is 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride.

Molecular Properties

Compound Name2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride
PubChem CID53407628
Molecular FormulaC11H16ClNO
Molecular Weight213.71 g/mol
Exact Mass213.09
IUPAC Name2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride
SMILESCOCC1(N)Cc2ccccc2C1.Cl
InChIInChI=1S/C11H15NO.ClH/c1-13-8-11(12)6-9-4-2-3-5-10(9)7-11;/h2-5H,6-8,12H2,1H3;1H
InChIKeyUQBRDILFRIXTBN-UHFFFAOYSA-N
XLogP1.55
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.71
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride?
The IUPAC name of 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride (CID 53407628) is 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride.
What is the SMILES notation for 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride?
The canonical SMILES for 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride is COCC1(N)Cc2ccccc2C1.Cl.
What is the InChIKey of 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride?
The InChIKey is UQBRDILFRIXTBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO.ClH/c1-13-8-11(12)6-9-4-2-3-5-10(9)7-11;/h2-5H,6-8,12H2,1H3;1H.
What are the key properties of 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride?
2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride has a molecular weight of 213.71 g/mol, XLogP of 1.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-1,3-dihydroinden-2-amine;hydrochloride is sourced from PubChem (CID 53407628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).