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

C18H26N2 — CID 64832099

IUPAC3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine
SMILESCC1(C2CC2)CN(Cc2ccc3c(c2)CCC3)CCN1
InChIInChI=1S/C18H26N2/c1-18(17-7-8-17)13-20(10-9-19-18)12-14-5-6-15-3-2-4-16(15)11-14/h5-6,11,17,19H,2-4,7-10,12-13H2,1H3
InChIKeyGLBYATAGMCJQQP-UHFFFAOYSA-N
MW270.42 g/mol
LogP2.75
Rot. Bonds3

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

3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine (PubChem CID 64832099) has the molecular formula C18H26N2 and a molecular weight of 270.42 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine.

Molecular Properties

Compound Name3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine
PubChem CID64832099
Molecular FormulaC18H26N2
Molecular Weight270.42 g/mol
Exact Mass270.21
IUPAC Name3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine
SMILESCC1(C2CC2)CN(Cc2ccc3c(c2)CCC3)CCN1
InChIInChI=1S/C18H26N2/c1-18(17-7-8-17)13-20(10-9-19-18)12-14-5-6-15-3-2-4-16(15)11-14/h5-6,11,17,19H,2-4,7-10,12-13H2,1H3
InChIKeyGLBYATAGMCJQQP-UHFFFAOYSA-N
XLogP2.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopropyl-1-[(3,5-difluorophenyl)methyl]-3-methylpiperazine
CID 105409901
3-cyclopropyl-1-[(3,4-dimethylphenyl)methyl]-3-methyl-1,4-diazepane
CID 64869909
6-[(3-cyclopropyl-3-methylpiperazin-1-yl)methyl]quinoline
CID 64831911
3-cyclopropyl-1-[(6-methoxy-3-pyridinyl)methyl]-3-methyl-1,4-diazepane
CID 64950976
3-cyclopropyl-1-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperazine
CID 64955002
1-[(2-bromophenyl)methyl]-3-cyclopropyl-3-methyl-1,4-diazepane
CID 64872279
2-[(3-cyclopropyl-3-methylpiperazin-1-yl)methyl]quinoline
CID 64834096
3-cyclopropyl-3-methyl-1-(pyrimidin-2-ylmethyl)-1,4-diazepane
CID 64871682
5-[(3-cyclopropyl-3-methylpiperazin-1-yl)methyl]-2-methyl-1,3-thiazole
CID 64925154
3-cyclopropyl-1-[(5-ethylthiophen-2-yl)methyl]-3-methyl-1,4-diazepane
CID 64872286
1-[(2-chlorophenyl)methyl]-3-cyclopropyl-3-methyl-1,4-diazepane
CID 64871685
3-bromo-1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrolidine
CID 80676340

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine?
The IUPAC name of 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine (CID 64832099) is 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine.
What is the SMILES notation for 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine?
The canonical SMILES for 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine is CC1(C2CC2)CN(Cc2ccc3c(c2)CCC3)CCN1.
What is the InChIKey of 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine?
The InChIKey is GLBYATAGMCJQQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2/c1-18(17-7-8-17)13-20(10-9-19-18)12-14-5-6-15-3-2-4-16(15)11-14/h5-6,11,17,19H,2-4,7-10,12-13H2,1H3.
What are the key properties of 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine?
3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine has a molecular weight of 270.42 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2,3-dihydro-1H-inden-5-ylmethyl)-3-methylpiperazine is sourced from PubChem (CID 64832099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).