2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine

C15H22N2 — CID 116928006

IUPAC2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine
SMILESCN1CCNCC1Cc1ccc2c(c1)CCC2
InChIInChI=1S/C15H22N2/c1-17-8-7-16-11-15(17)10-12-5-6-13-3-2-4-14(13)9-12/h5-6,9,15-16H,2-4,7-8,10-11H2,1H3
InChIKeyBJEVBRDCLLPRTD-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.62
Rot. Bonds2

About 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine

2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine (PubChem CID 116928006) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine
PubChem CID116928006
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine
SMILESCN1CCNCC1Cc1ccc2c(c1)CCC2
InChIInChI=1S/C15H22N2/c1-17-8-7-16-11-15(17)10-12-5-6-13-3-2-4-14(13)9-12/h5-6,9,15-16H,2-4,7-8,10-11H2,1H3
InChIKeyBJEVBRDCLLPRTD-UHFFFAOYSA-N
XLogP1.62
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,4-dihydro-2H-chromen-6-ylmethyl)-1-methylpiperazine
CID 116928055
(2R)-2-[(3,4-dimethylphenyl)methyl]-1-methylpiperazine
CID 95442733
(2S)-2-[(3,4-dimethylphenyl)methyl]-1-methylpiperazine;dihydrochloride
CID 154574727
1-methyl-2-[(4-pyrrolidin-3-ylphenyl)methyl]piperazine
CID 116988478
5-[(1-methylpiperazin-2-yl)methyl]-1,3-dihydrobenzimidazol-2-one
CID 116928064
1,2-dimethyl-5-[(1-methylpiperazin-2-yl)methyl]indole
CID 116996446
2-methyl-6-[(1-methylpiperazin-2-yl)methyl]-1,3-benzoxazole
CID 116928063
4-[(1-methylpiperazin-2-yl)methyl]benzoic acid
CID 18440347
6-[(1-methylpiperazin-2-yl)methyl]-1H-benzimidazole
CID 116928065
2-[(4-ethoxyphenyl)methyl]-1-methylpiperazine
CID 116928023
1-(2,3-dihydro-1H-inden-5-ylmethyl)-2-methylpiperazine;hydrochloride
CID 119916469
3-(2,3-dihydro-1H-inden-5-ylmethyl)-4-methylpiperidine
CID 106779364

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine?
The IUPAC name of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine (CID 116928006) is 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine.
What is the SMILES notation for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine?
The canonical SMILES for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine is CN1CCNCC1Cc1ccc2c(c1)CCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine?
The InChIKey is BJEVBRDCLLPRTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-17-8-7-16-11-15(17)10-12-5-6-13-3-2-4-14(13)9-12/h5-6,9,15-16H,2-4,7-8,10-11H2,1H3.
What are the key properties of 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine?
2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine has a molecular weight of 230.35 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-inden-5-ylmethyl)-1-methylpiperazine is sourced from PubChem (CID 116928006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).