2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine

C15H23N3 — CID 114086669

IUPAC2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCC1CN(C)CCN1C1Cc2ccccc2C1N
InChIInChI=1S/C15H23N3/c1-11-10-17(2)7-8-18(11)14-9-12-5-3-4-6-13(12)15(14)16/h3-6,11,14-15H,7-10,16H2,1-2H3
InChIKeyOEEOTRNLMNUOPD-UHFFFAOYSA-N
MW245.37 g/mol
LogP1.25
Rot. Bonds1

About 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine

2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 114086669) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound Name2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine
PubChem CID114086669
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC Name2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCC1CN(C)CCN1C1Cc2ccccc2C1N
InChIInChI=1S/C15H23N3/c1-11-10-17(2)7-8-18(11)14-9-12-5-3-4-6-13(12)15(14)16/h3-6,11,14-15H,7-10,16H2,1-2H3
InChIKeyOEEOTRNLMNUOPD-UHFFFAOYSA-N
XLogP1.25
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpyrrolidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 60974611
6-(4-methylpiperazin-1-yl)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 16783923
1-(1-amino-2,3-dihydro-1H-inden-2-yl)-N,N-dimethylpyrrolidin-3-amine
CID 63164297
(1S)-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 59444842
(1R)-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 55285370
(1S,2R)-2-methyl-2,3-dihydro-1H-inden-1-amine
CID 51899506
2-(2-propylpiperidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 83053277
(6R,11bR)-2-methyl-6-phenyl-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinoline
CID 70416585
2-N-methyl-2-N-[(1-methylpyrrolidin-3-yl)methyl]-2,3-dihydro-1H-indene-1,2-diamine
CID 63275813
(5S)-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-5-amine
CID 141299186
2-(3-methoxypiperidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 102965518
2-(2,2-dimethylmorpholin-4-yl)-2,3-dihydro-1H-inden-1-amine
CID 43592735

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine (CID 114086669) is 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine is CC1CN(C)CCN1C1Cc2ccccc2C1N.
What is the InChIKey of 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is OEEOTRNLMNUOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-11-10-17(2)7-8-18(11)14-9-12-5-3-4-6-13(12)15(14)16/h3-6,11,14-15H,7-10,16H2,1-2H3.
What are the key properties of 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine?
2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 245.37 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylpiperazin-1-yl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 114086669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).