N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine

C9H12N2O — CID 144626033

IUPACN-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine
SMILESNC1c2ccccc2CC1NO
InChIInChI=1S/C9H12N2O/c10-9-7-4-2-1-3-6(7)5-8(9)11-12/h1-4,8-9,11-12H,5,10H2
InChIKeyQWGPKPBUDVMOIS-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.59
Rot. Bonds1

About N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine

N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine (PubChem CID 144626033) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine
PubChem CID144626033
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC NameN-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine
SMILESNC1c2ccccc2CC1NO
InChIInChI=1S/C9H12N2O/c10-9-7-4-2-1-3-6(7)5-8(9)11-12/h1-4,8-9,11-12H,5,10H2
InChIKeyQWGPKPBUDVMOIS-UHFFFAOYSA-N
XLogP0.59
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]propanamide
CID 165456832
(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-ol;hydrochloride
CID 122360167
2,3-dihydro-1H-indene-1,2-diamine
CID 10986398
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]pyridine-4-carboxamide
CID 142582886
N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide
CID 166991162
(1S,2R)-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 51899506
2-chloro-2,3-dihydro-1H-inden-1-amine
CID 2794190
(1S,2R)-2-bromo-2,3-dihydro-1H-inden-1-amine
CID 131850845
(1S)-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 59444842
(1R)-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 55285370
(1R,2S)-1-amino-2,3-dihydro-1H-indene-2-carboxylic acid
CID 70327463
bicyclo[4.2.0]octa-1,3,5-trien-7-amine
CID 2753029

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine?
The IUPAC name of N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine (CID 144626033) is N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine.
What is the SMILES notation for N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine?
The canonical SMILES for N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine is NC1c2ccccc2CC1NO.
What is the InChIKey of N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine?
The InChIKey is QWGPKPBUDVMOIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c10-9-7-4-2-1-3-6(7)5-8(9)11-12/h1-4,8-9,11-12H,5,10H2.
What are the key properties of N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine?
N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine has a molecular weight of 164.21 g/mol, XLogP of 0.59, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine is sourced from PubChem (CID 144626033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).