1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine

C16H24N2O — CID 79374347

IUPAC1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine
SMILESCOc1ccc2c(c1)C(N1CC(C)NCC1C)CC2
InChIInChI=1S/C16H24N2O/c1-11-10-18(12(2)9-17-11)16-7-5-13-4-6-14(19-3)8-15(13)16/h4,6,8,11-12,16-17H,5,7,9-10H2,1-3H3
InChIKeySICLHVALPMTQNK-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.36
Rot. Bonds2

About 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine

1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine (PubChem CID 79374347) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine.

Molecular Properties

Compound Name1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine
PubChem CID79374347
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine
SMILESCOc1ccc2c(c1)C(N1CC(C)NCC1C)CC2
InChIInChI=1S/C16H24N2O/c1-11-10-18(12(2)9-17-11)16-7-5-13-4-6-14(19-3)8-15(13)16/h4,6,8,11-12,16-17H,5,7,9-10H2,1-3H3
InChIKeySICLHVALPMTQNK-UHFFFAOYSA-N
XLogP2.36
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-2,5-dimethylpiperazine
CID 64979039
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102677859
[1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-4-methylpiperazin-2-yl]methanamine
CID 80504502
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)azetidine-3-carboxylic acid
CID 79368867
1-[1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)pyrrolidin-2-yl]-N-methylmethanamine
CID 115316047
1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)-3-methylpiperazine
CID 115510854
6-methoxy-2,3-dihydro-1H-indene-1-thiol
CID 79374496
(2S,5R)-1-(4-methoxyphenyl)-2,5-dimethylpiperazine
CID 95443898
(2S,5R)-1-(3-methoxyphenyl)-2,5-dimethylpiperazine
CID 95443891
(4R)-6-methoxy-4-(4-methylpiperazin-1-yl)-1,2,3,4-tetrahydroisoquinoline
CID 9169269
6-methoxy-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627821
N-cyclopropyl-6-methoxy-2,3-dihydro-1H-inden-1-amine
CID 79366110

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine?
The IUPAC name of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine (CID 79374347) is 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine.
What is the SMILES notation for 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine?
The canonical SMILES for 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine is COc1ccc2c(c1)C(N1CC(C)NCC1C)CC2.
What is the InChIKey of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine?
The InChIKey is SICLHVALPMTQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-11-10-18(12(2)9-17-11)16-7-5-13-4-6-14(19-3)8-15(13)16/h4,6,8,11-12,16-17H,5,7,9-10H2,1-3H3.
What are the key properties of 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine?
1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine has a molecular weight of 260.38 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxy-2,3-dihydro-1H-inden-1-yl)-2,5-dimethylpiperazine is sourced from PubChem (CID 79374347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).