2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol

C10H14N2O — CID 22261265

IUPAC2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol
SMILESCN(N)C1Cc2ccccc2C1O
InChIInChI=1S/C10H14N2O/c1-12(11)9-6-7-4-2-3-5-8(7)10(9)13/h2-5,9-10,13H,6,11H2,1H3
InChIKeyDYPFWPZTPLZNEM-UHFFFAOYSA-N
MW178.24 g/mol
LogP0.45
Rot. Bonds1

About 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol

2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol (PubChem CID 22261265) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol.

Molecular Properties

Compound Name2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol
PubChem CID22261265
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol
SMILESCN(N)C1Cc2ccccc2C1O
InChIInChI=1S/C10H14N2O/c1-12(11)9-6-7-4-2-3-5-8(7)10(9)13/h2-5,9-10,13H,6,11H2,1H3
InChIKeyDYPFWPZTPLZNEM-UHFFFAOYSA-N
XLogP0.45
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol?
The IUPAC name of 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol (CID 22261265) is 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol.
What is the SMILES notation for 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol?
The canonical SMILES for 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol is CN(N)C1Cc2ccccc2C1O.
What is the InChIKey of 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol?
The InChIKey is DYPFWPZTPLZNEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-12(11)9-6-7-4-2-3-5-8(7)10(9)13/h2-5,9-10,13H,6,11H2,1H3.
What are the key properties of 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol?
2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol has a molecular weight of 178.24 g/mol, XLogP of 0.45, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[amino(methyl)amino]-2,3-dihydro-1H-inden-1-ol is sourced from PubChem (CID 22261265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).