4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride

C9H10Cl3N — CID 134818625

IUPAC4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride
SMILESCl.NC1Cc2ccc(Cl)c(Cl)c2C1
InChIInChI=1S/C9H9Cl2N.ClH/c10-8-2-1-5-3-6(12)4-7(5)9(8)11;/h1-2,6H,3-4,12H2;1H
InChIKeyVSAIWXFSACADRO-UHFFFAOYSA-N
MW238.54 g/mol
LogP2.84
Rot. Bonds

About 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride

4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride (PubChem CID 134818625) has the molecular formula C9H10Cl3N and a molecular weight of 238.54 g/mol. Its IUPAC name is 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride.

Molecular Properties

Compound Name4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride
PubChem CID134818625
Molecular FormulaC9H10Cl3N
Molecular Weight238.54 g/mol
Exact Mass236.99
IUPAC Name4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride
SMILESCl.NC1Cc2ccc(Cl)c(Cl)c2C1
InChIInChI=1S/C9H9Cl2N.ClH/c10-8-2-1-5-3-6(12)4-7(5)9(8)11;/h1-2,6H,3-4,12H2;1H
InChIKeyVSAIWXFSACADRO-UHFFFAOYSA-N
XLogP2.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.54
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-5-chloro-1,2,3,4-tetrahydronaphthalene-2,6-diamine
CID 130898043
5-chloro-2,3-dihydro-1H-inden-2-amine;2,3-dihydro-1H-inden-2-amine
CID 167560808
8-amino-4,7,8,9-tetrahydro-3H-cyclopenta[h]chromen-2-one
CID 171725940
5,6-dichloro-3,4-dihydro-1H-isochromen-4-amine;hydrochloride
CID 134205941
(3S)-7-chloro-8-fluoro-3,4-dihydro-2H-chromen-3-amine
CID 137480705
2,3-dihydro-1H-inden-2-amine;ethane
CID 142154792
(2R)-5-chloro-7-fluoro-1,2,3,4-tetrahydronaphthalen-2-amine
CID 131191332
benzene;ruthenium;1,2,3,4-tetrachlorobenzene
CID 173000636
5-bromo-2,3-dihydro-1H-inden-2-amine
CID 11298795
N-[[4-[(5,6-dichloro-1,2,3,4-tetrahydronaphthalen-2-yl)methyl]phenyl]methyl]-3-methylbutan-2-amine
CID 59058089
6,7-dichloro-2-methyl-2,3-dihydroinden-1-one
CID 22173116
2-amino-6-chloro-2,3-dihydro-1H-indene-5-sulfonic acid
CID 87318236

Frequently Asked Questions

What is the IUPAC name of 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride?
The IUPAC name of 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride (CID 134818625) is 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride.
What is the SMILES notation for 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride?
The canonical SMILES for 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride is Cl.NC1Cc2ccc(Cl)c(Cl)c2C1.
What is the InChIKey of 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride?
The InChIKey is VSAIWXFSACADRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Cl2N.ClH/c10-8-2-1-5-3-6(12)4-7(5)9(8)11;/h1-2,6H,3-4,12H2;1H.
What are the key properties of 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride?
4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride has a molecular weight of 238.54 g/mol, XLogP of 2.84, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dichloro-2,3-dihydro-1H-inden-2-amine;hydrochloride is sourced from PubChem (CID 134818625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).