10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane

C15H20BrClN2 — CID 64943983

IUPAC10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane
SMILESClc1cc(Br)ccc1N1CCCNC2(CCCC2)C1
InChIInChI=1S/C15H20BrClN2/c16-12-4-5-14(13(17)10-12)19-9-3-8-18-15(11-19)6-1-2-7-15/h4-5,10,18H,1-3,6-9,11H2
InChIKeyCPHUGSWVLJFEPO-UHFFFAOYSA-N
MW343.70 g/mol
LogP4.22
Rot. Bonds1

About 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane

10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane (PubChem CID 64943983) has the molecular formula C15H20BrClN2 and a molecular weight of 343.70 g/mol. Its IUPAC name is 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane
PubChem CID64943983
Molecular FormulaC15H20BrClN2
Molecular Weight343.70 g/mol
Exact Mass342.05
IUPAC Name10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane
SMILESClc1cc(Br)ccc1N1CCCNC2(CCCC2)C1
InChIInChI=1S/C15H20BrClN2/c16-12-4-5-14(13(17)10-12)19-9-3-8-18-15(11-19)6-1-2-7-15/h4-5,10,18H,1-3,6-9,11H2
InChIKeyCPHUGSWVLJFEPO-UHFFFAOYSA-N
XLogP4.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.70
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

10-(4-bromo-2-methylphenyl)-6,10-diazaspiro[4.6]undecane
CID 64943378
10-(5-bromo-2-methylphenyl)-6,10-diazaspiro[4.6]undecane
CID 64942821
11-(4-bromo-2,5-difluorophenyl)-7,11-diazaspiro[5.6]dodecane
CID 107608134
4-(2,4,5-trichlorophenyl)-1,4-diazaspiro[5.5]undecane
CID 64926469
1-(5-bromo-2-chlorophenyl)-3-cyclopropyl-3-methyl-1,4-diazepane
CID 64949392
4-(5-bromo-2-methoxyphenyl)-1,4-diazaspiro[5.5]undecane
CID 64954511
9-(4-bromo-2-chlorophenyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 64935889
10-(3-chlorophenyl)-6,10-diazaspiro[4.6]undecane
CID 64944935
1-(4-bromo-2-chlorophenyl)-3,3-diethylpiperazine
CID 64925092
10-(3-bromo-4-methylphenyl)-6,10-diazaspiro[4.6]undecane
CID 64950005
10-(5-bromo-4-fluoro-2-methylphenyl)-6,10-diazaspiro[4.6]undecane
CID 107594271
11-(4-iodophenyl)-7,11-diazaspiro[5.6]dodecane
CID 64943004

Frequently Asked Questions

What is the IUPAC name of 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane (CID 64943983) is 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane is Clc1cc(Br)ccc1N1CCCNC2(CCCC2)C1.
What is the InChIKey of 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane?
The InChIKey is CPHUGSWVLJFEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrClN2/c16-12-4-5-14(13(17)10-12)19-9-3-8-18-15(11-19)6-1-2-7-15/h4-5,10,18H,1-3,6-9,11H2.
What are the key properties of 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane?
10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane has a molecular weight of 343.70 g/mol, XLogP of 4.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-bromo-2-chlorophenyl)-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 64943983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).