4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine

C11H14ClN — CID 23396987

IUPAC4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine
SMILESCCNC1Cc2cccc(Cl)c2C1
InChIInChI=1S/C11H14ClN/c1-2-13-9-6-8-4-3-5-11(12)10(8)7-9/h3-5,9,13H,2,6-7H2,1H3
InChIKeyOSFKMGBNFSQCOJ-UHFFFAOYSA-N
MW195.69 g/mol
LogP2.42
Rot. Bonds2

About 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine

4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine (PubChem CID 23396987) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound Name4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine
PubChem CID23396987
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC Name4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine
SMILESCCNC1Cc2cccc(Cl)c2C1
InChIInChI=1S/C11H14ClN/c1-2-13-9-6-8-4-3-5-11(12)10(8)7-9/h3-5,9,13H,2,6-7H2,1H3
InChIKeyOSFKMGBNFSQCOJ-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine (CID 23396987) is 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine is CCNC1Cc2cccc(Cl)c2C1.
What is the InChIKey of 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine?
The InChIKey is OSFKMGBNFSQCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN/c1-2-13-9-6-8-4-3-5-11(12)10(8)7-9/h3-5,9,13H,2,6-7H2,1H3.
What are the key properties of 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine?
4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine has a molecular weight of 195.69 g/mol, XLogP of 2.42, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 23396987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).