2,3-dihydroindol-1-amine;dihydrochloride

C8H12Cl2N2 — CID 172716948

IUPAC2,3-dihydroindol-1-amine;dihydrochloride
SMILESCl.Cl.NN1CCc2ccccc21
InChIInChI=1S/C8H10N2.2ClH/c9-10-6-5-7-3-1-2-4-8(7)10;;/h1-4H,5-6,9H2;2*1H
InChIKeyFZJQOPCUPDTVDN-UHFFFAOYSA-N
MW207.10 g/mol
LogP1.77
Rot. Bonds

About 2,3-dihydroindol-1-amine;dihydrochloride

2,3-dihydroindol-1-amine;dihydrochloride (PubChem CID 172716948) has the molecular formula C8H12Cl2N2 and a molecular weight of 207.10 g/mol. Its IUPAC name is 2,3-dihydroindol-1-amine;dihydrochloride.

Molecular Properties

Compound Name2,3-dihydroindol-1-amine;dihydrochloride
PubChem CID172716948
Molecular FormulaC8H12Cl2N2
Molecular Weight207.10 g/mol
Exact Mass206.04
IUPAC Name2,3-dihydroindol-1-amine;dihydrochloride
SMILESCl.Cl.NN1CCc2ccccc21
InChIInChI=1S/C8H10N2.2ClH/c9-10-6-5-7-3-1-2-4-8(7)10;;/h1-4H,5-6,9H2;2*1H
InChIKeyFZJQOPCUPDTVDN-UHFFFAOYSA-N
XLogP1.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.10
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3-dihydroindol-1-ylsilane
CID 149251229
2,3-dihydroindol-1-yl(trifluoro)-λ4-sulfane
CID 20650007
6-bromo-2,3-dihydroindol-1-amine
CID 22612697
2-(2,3-dihydroindol-1-yl)ethanamine
CID 1072384
1,2-dimethyl-3,4-dihydrocinnoline
CID 54095235
2-(2,3-dihydroindol-1-yl)ethanol;hydrochloride
CID 169005265
3-(2,3-dihydroindol-1-yl)cyclobutan-1-amine
CID 80561205
1-azido-2,3-dihydroindole
CID 54253401
1-(chloromethyl)-2,3-dihydroindole
CID 59108457
1-pyrrolidin-1-ylsulfonyl-2,3-dihydroindole
CID 110705798
2,3-dihydroindol-1-ylurea
CID 22353227
N'-hydroxy-2,3-dihydroindole-1-carboximidamide
CID 126972145

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroindol-1-amine;dihydrochloride?
The IUPAC name of 2,3-dihydroindol-1-amine;dihydrochloride (CID 172716948) is 2,3-dihydroindol-1-amine;dihydrochloride.
What is the SMILES notation for 2,3-dihydroindol-1-amine;dihydrochloride?
The canonical SMILES for 2,3-dihydroindol-1-amine;dihydrochloride is Cl.Cl.NN1CCc2ccccc21.
What is the InChIKey of 2,3-dihydroindol-1-amine;dihydrochloride?
The InChIKey is FZJQOPCUPDTVDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2.2ClH/c9-10-6-5-7-3-1-2-4-8(7)10;;/h1-4H,5-6,9H2;2*1H.
What are the key properties of 2,3-dihydroindol-1-amine;dihydrochloride?
2,3-dihydroindol-1-amine;dihydrochloride has a molecular weight of 207.10 g/mol, XLogP of 1.77, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroindol-1-amine;dihydrochloride is sourced from PubChem (CID 172716948), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).