2,3-dihydro-1H-indene-1,4-diamine

C9H12N2 — CID 55293440

IUPAC2,3-dihydro-1H-indene-1,4-diamine
SMILESNc1cccc2c1CCC2N
InChIInChI=1S/C9H12N2/c10-8-3-1-2-6-7(8)4-5-9(6)11/h1-3,9H,4-5,10-11H2
InChIKeyFYDSNMUXGSWXQN-UHFFFAOYSA-N
MW148.21 g/mol
LogP1.21
Rot. Bonds

About 2,3-dihydro-1H-indene-1,4-diamine

2,3-dihydro-1H-indene-1,4-diamine (PubChem CID 55293440) has the molecular formula C9H12N2 and a molecular weight of 148.21 g/mol. Its IUPAC name is 2,3-dihydro-1H-indene-1,4-diamine.

Molecular Properties

Compound Name2,3-dihydro-1H-indene-1,4-diamine
PubChem CID55293440
Molecular FormulaC9H12N2
Molecular Weight148.21 g/mol
Exact Mass148.10
IUPAC Name2,3-dihydro-1H-indene-1,4-diamine
SMILESNc1cccc2c1CCC2N
InChIInChI=1S/C9H12N2/c10-8-3-1-2-6-7(8)4-5-9(6)11/h1-3,9H,4-5,10-11H2
InChIKeyFYDSNMUXGSWXQN-UHFFFAOYSA-N
XLogP1.21
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.21
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indene-1,4-diamine?
The IUPAC name of 2,3-dihydro-1H-indene-1,4-diamine (CID 55293440) is 2,3-dihydro-1H-indene-1,4-diamine.
What is the SMILES notation for 2,3-dihydro-1H-indene-1,4-diamine?
The canonical SMILES for 2,3-dihydro-1H-indene-1,4-diamine is Nc1cccc2c1CCC2N.
What is the InChIKey of 2,3-dihydro-1H-indene-1,4-diamine?
The InChIKey is FYDSNMUXGSWXQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2/c10-8-3-1-2-6-7(8)4-5-9(6)11/h1-3,9H,4-5,10-11H2.
What are the key properties of 2,3-dihydro-1H-indene-1,4-diamine?
2,3-dihydro-1H-indene-1,4-diamine has a molecular weight of 148.21 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indene-1,4-diamine is sourced from PubChem (CID 55293440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).