5-azido-2,3-dihydro-1H-inden-4-amine

C9H10N4 — CID 141479420

IUPAC5-azido-2,3-dihydro-1H-inden-4-amine
SMILES[N-]=[N+]=Nc1ccc2c(c1N)CCC2
InChIInChI=1S/C9H10N4/c10-9-7-3-1-2-6(7)4-5-8(9)12-13-11/h4-5H,1-3,10H2
InChIKeyHSFGFOUOSZDTAM-UHFFFAOYSA-N
MW174.21 g/mol
LogP2.70
Rot. Bonds1

About 5-azido-2,3-dihydro-1H-inden-4-amine

5-azido-2,3-dihydro-1H-inden-4-amine (PubChem CID 141479420) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 5-azido-2,3-dihydro-1H-inden-4-amine.

Molecular Properties

Compound Name5-azido-2,3-dihydro-1H-inden-4-amine
PubChem CID141479420
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name5-azido-2,3-dihydro-1H-inden-4-amine
SMILES[N-]=[N+]=Nc1ccc2c(c1N)CCC2
InChIInChI=1S/C9H10N4/c10-9-7-3-1-2-6(7)4-5-8(9)12-13-11/h4-5H,1-3,10H2
InChIKeyHSFGFOUOSZDTAM-UHFFFAOYSA-N
XLogP2.70
TPSA74.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

5-cyclopropyl-2,3-dihydro-1H-inden-4-amine
CID 162394390
5,12-diazidotricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
CID 10924242
ethane;ethene;1,2,3,5,6,7-hexahydro-s-indacen-4-amine
CID 145387694
8-azido-5-methoxy-3,4-dihydro-2H-naphthalen-1-one
CID 15313226
5-[(2S)-azetidin-2-yl]-2,3-dihydro-1H-inden-4-amine
CID 130655160
5-(oxan-4-yl)-2,3-dihydro-1H-inden-4-amine
CID 147187055
azaniumylideneazanide;5-azidotricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaene
CID 138453615
5-bromo-6-methyl-2,3-dihydro-1H-inden-4-amine
CID 146380579
5-[(E)-4-ethenyliminobut-2-en-2-yl]-2,3-dihydro-1H-inden-4-amine
CID 155313281
5-(6-fluoro-3-pyridinyl)-2,3-dihydro-1H-inden-4-amine
CID 170600909
5-methylidene-2,3,6,7-tetrahydro-1H-s-indacen-4-amine
CID 142522585
3,5,6,7-tetrahydro-2H-cyclopenta[f][1]benzofuran-4-amine
CID 122480718

Frequently Asked Questions

What is the IUPAC name of 5-azido-2,3-dihydro-1H-inden-4-amine?
The IUPAC name of 5-azido-2,3-dihydro-1H-inden-4-amine (CID 141479420) is 5-azido-2,3-dihydro-1H-inden-4-amine.
What is the SMILES notation for 5-azido-2,3-dihydro-1H-inden-4-amine?
The canonical SMILES for 5-azido-2,3-dihydro-1H-inden-4-amine is [N-]=[N+]=Nc1ccc2c(c1N)CCC2.
What is the InChIKey of 5-azido-2,3-dihydro-1H-inden-4-amine?
The InChIKey is HSFGFOUOSZDTAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c10-9-7-3-1-2-6(7)4-5-8(9)12-13-11/h4-5H,1-3,10H2.
What are the key properties of 5-azido-2,3-dihydro-1H-inden-4-amine?
5-azido-2,3-dihydro-1H-inden-4-amine has a molecular weight of 174.21 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-azido-2,3-dihydro-1H-inden-4-amine is sourced from PubChem (CID 141479420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).