N-methoxy-1H-inden-2-amine

C10H11NO — CID 91075620

IUPACN-methoxy-1H-inden-2-amine
SMILESCONC1=Cc2ccccc2C1
InChIInChI=1S/C10H11NO/c1-12-11-10-6-8-4-2-3-5-9(8)7-10/h2-6,11H,7H2,1H3
InChIKeyPSNGULYUPDORJL-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.73
Rot. Bonds2

About N-methoxy-1H-inden-2-amine

N-methoxy-1H-inden-2-amine (PubChem CID 91075620) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is N-methoxy-1H-inden-2-amine.

Molecular Properties

Compound NameN-methoxy-1H-inden-2-amine
PubChem CID91075620
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC NameN-methoxy-1H-inden-2-amine
SMILESCONC1=Cc2ccccc2C1
InChIInChI=1S/C10H11NO/c1-12-11-10-6-8-4-2-3-5-9(8)7-10/h2-6,11H,7H2,1H3
InChIKeyPSNGULYUPDORJL-UHFFFAOYSA-N
XLogP1.73
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-1H-inden-2-amine?
The IUPAC name of N-methoxy-1H-inden-2-amine (CID 91075620) is N-methoxy-1H-inden-2-amine.
What is the SMILES notation for N-methoxy-1H-inden-2-amine?
The canonical SMILES for N-methoxy-1H-inden-2-amine is CONC1=Cc2ccccc2C1.
What is the InChIKey of N-methoxy-1H-inden-2-amine?
The InChIKey is PSNGULYUPDORJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-12-11-10-6-8-4-2-3-5-9(8)7-10/h2-6,11H,7H2,1H3.
What are the key properties of N-methoxy-1H-inden-2-amine?
N-methoxy-1H-inden-2-amine has a molecular weight of 161.20 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-1H-inden-2-amine is sourced from PubChem (CID 91075620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).