N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine

C15H24N2 — CID 169244288

IUPACN,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine
SMILESCC(C)c1ccc2c(c1)[C@@H](CCN(C)C)CN2
InChIInChI=1S/C15H24N2/c1-11(2)12-5-6-15-14(9-12)13(10-16-15)7-8-17(3)4/h5-6,9,11,13,16H,7-8,10H2,1-4H3/t13-/m0/s1
InChIKeyRYXGKJHKUWPQHB-ZDUSSCGKSA-N
MW232.37 g/mol
LogP3.27
Rot. Bonds4

About N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine

N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine (PubChem CID 169244288) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine
PubChem CID169244288
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine
SMILESCC(C)c1ccc2c(c1)[C@@H](CCN(C)C)CN2
InChIInChI=1S/C15H24N2/c1-11(2)12-5-6-15-14(9-12)13(10-16-15)7-8-17(3)4/h5-6,9,11,13,16H,7-8,10H2,1-4H3/t13-/m0/s1
InChIKeyRYXGKJHKUWPQHB-ZDUSSCGKSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine?
The IUPAC name of N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine (CID 169244288) is N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine.
What is the SMILES notation for N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine?
The canonical SMILES for N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine is CC(C)c1ccc2c(c1)[C@@H](CCN(C)C)CN2.
What is the InChIKey of N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine?
The InChIKey is RYXGKJHKUWPQHB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H24N2/c1-11(2)12-5-6-15-14(9-12)13(10-16-15)7-8-17(3)4/h5-6,9,11,13,16H,7-8,10H2,1-4H3/t13-/m0/s1.
What are the key properties of N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine?
N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine has a molecular weight of 232.37 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[(3R)-5-propan-2-yl-2,3-dihydro-1H-indol-3-yl]ethanamine is sourced from PubChem (CID 169244288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).