(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine

C10H12ClN — CID 55275438

IUPAC(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1cc(Cl)cc2c1CC[C@H]2N
InChIInChI=1S/C10H12ClN/c1-6-4-7(11)5-9-8(6)2-3-10(9)12/h4-5,10H,2-3,12H2,1H3/t10-/m1/s1
InChIKeyAPENXSRDYAVMSS-SNVBAGLBSA-N
MW181.67 g/mol
LogP2.59
Rot. Bonds

About (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine

(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine (PubChem CID 55275438) has the molecular formula C10H12ClN and a molecular weight of 181.67 g/mol. Its IUPAC name is (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine
PubChem CID55275438
Molecular FormulaC10H12ClN
Molecular Weight181.67 g/mol
Exact Mass181.07
IUPAC Name(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine
SMILESCc1cc(Cl)cc2c1CC[C@H]2N
InChIInChI=1S/C10H12ClN/c1-6-4-7(11)5-9-8(6)2-3-10(9)12/h4-5,10H,2-3,12H2,1H3/t10-/m1/s1
InChIKeyAPENXSRDYAVMSS-SNVBAGLBSA-N
XLogP2.59
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.67
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine (CID 55275438) is (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine is Cc1cc(Cl)cc2c1CC[C@H]2N.
What is the InChIKey of (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine?
The InChIKey is APENXSRDYAVMSS-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H12ClN/c1-6-4-7(11)5-9-8(6)2-3-10(9)12/h4-5,10H,2-3,12H2,1H3/t10-/m1/s1.
What are the key properties of (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine?
(1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine has a molecular weight of 181.67 g/mol, XLogP of 2.59, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-6-chloro-4-methyl-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 55275438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).