2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane

C18H25ClN2 — CID 102849461

IUPAC2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane
SMILESClc1ccc2c(c1)CCC2N1CCCC2(CCCNC2)C1
InChIInChI=1S/C18H25ClN2/c19-15-4-5-16-14(11-15)3-6-17(16)21-10-2-8-18(13-21)7-1-9-20-12-18/h4-5,11,17,20H,1-3,6-10,12-13H2
InChIKeyQLRBYYZOCXGOMW-UHFFFAOYSA-N
MW304.86 g/mol
LogP3.79
Rot. Bonds1

About 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane

2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane (PubChem CID 102849461) has the molecular formula C18H25ClN2 and a molecular weight of 304.86 g/mol. Its IUPAC name is 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane
PubChem CID102849461
Molecular FormulaC18H25ClN2
Molecular Weight304.86 g/mol
Exact Mass304.17
IUPAC Name2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane
SMILESClc1ccc2c(c1)CCC2N1CCCC2(CCCNC2)C1
InChIInChI=1S/C18H25ClN2/c19-15-4-5-16-14(11-15)3-6-17(16)21-10-2-8-18(13-21)7-1-9-20-12-18/h4-5,11,17,20H,1-3,6-10,12-13H2
InChIKeyQLRBYYZOCXGOMW-UHFFFAOYSA-N
XLogP3.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.86
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(2,5-dichlorophenyl)methyl]-2,8-diazaspiro[5.5]undecane
CID 82038748
1-(2-azaspiro[3.6]decan-2-yl)-2,3-dihydro-1H-inden-5-amine
CID 79721711
1-(2-azaspiro[3.5]nonan-2-yl)-2,3-dihydro-1H-inden-5-amine
CID 79746635
1-(5-chloro-2,3-dihydro-1H-inden-1-yl)-4-methylpyrrolidin-3-amine
CID 103575624
3-(2,8-diazaspiro[5.5]undecan-2-yl)azepan-2-one
CID 102850218
(5-chloro-2-fluorophenyl)-(2,8-diazaspiro[5.5]undecan-2-yl)methanone
CID 102849841
(1S)-1-pyrrolidin-1-yl-2,3-dihydro-1H-inden-5-ol
CID 129390892
(1S)-1-piperidin-1-yl-2,3-dihydro-1H-inden-5-ol
CID 129389365
2,8-diazaspiro[5.5]undecan-2-yl-(2,6-dichlorophenyl)methanone
CID 102849563
1-[1-(5-chloro-2,3-dihydro-1H-inden-1-yl)pyrrolidin-3-yl]ethanamine
CID 103975645
6-chloro-2-piperazin-1-yl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 84640322
(5R,6S)-5-[4-(2,7-diazaspiro[4.5]decan-7-yl)phenyl]-6-phenyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 164923491

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane?
The IUPAC name of 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane (CID 102849461) is 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane.
What is the SMILES notation for 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane?
The canonical SMILES for 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane is Clc1ccc2c(c1)CCC2N1CCCC2(CCCNC2)C1.
What is the InChIKey of 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane?
The InChIKey is QLRBYYZOCXGOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25ClN2/c19-15-4-5-16-14(11-15)3-6-17(16)21-10-2-8-18(13-21)7-1-9-20-12-18/h4-5,11,17,20H,1-3,6-10,12-13H2.
What are the key properties of 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane?
2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane has a molecular weight of 304.86 g/mol, XLogP of 3.79, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2,3-dihydro-1H-inden-1-yl)-2,8-diazaspiro[5.5]undecane is sourced from PubChem (CID 102849461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).