7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine

C11H14ClN — CID 155205881

IUPAC7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CCc2cc(C)cc(Cl)c21
InChIInChI=1S/C11H14ClN/c1-7-5-8-3-4-10(13-2)11(8)9(12)6-7/h5-6,10,13H,3-4H2,1-2H3
InChIKeyPVBTZLROYUGOAT-UHFFFAOYSA-N
MW195.69 g/mol
LogP2.86
Rot. Bonds1

About 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine

7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 155205881) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine
PubChem CID155205881
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC Name7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine
SMILESCNC1CCc2cc(C)cc(Cl)c21
InChIInChI=1S/C11H14ClN/c1-7-5-8-3-4-10(13-2)11(8)9(12)6-7/h5-6,10,13H,3-4H2,1-2H3
InChIKeyPVBTZLROYUGOAT-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine (CID 155205881) is 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine is CNC1CCc2cc(C)cc(Cl)c21.
What is the InChIKey of 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is PVBTZLROYUGOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN/c1-7-5-8-3-4-10(13-2)11(8)9(12)6-7/h5-6,10,13H,3-4H2,1-2H3.
What are the key properties of 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine?
7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 195.69 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-N,5-dimethyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 155205881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).