10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane

C16H22Cl2N2 — CID 64870099

IUPAC10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
SMILESClc1cccc(Cl)c1CN1CCCNC2(CCCC2)C1
InChIInChI=1S/C16H22Cl2N2/c17-14-5-3-6-15(18)13(14)11-20-10-4-9-19-16(12-20)7-1-2-8-16/h3,5-6,19H,1-2,4,7-12H2
InChIKeyDZLHEHCHOUPYGB-UHFFFAOYSA-N
MW313.27 g/mol
LogP4.10
Rot. Bonds2

About 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane

10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane (PubChem CID 64870099) has the molecular formula C16H22Cl2N2 and a molecular weight of 313.27 g/mol. Its IUPAC name is 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
PubChem CID64870099
Molecular FormulaC16H22Cl2N2
Molecular Weight313.27 g/mol
Exact Mass312.12
IUPAC Name10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
SMILESClc1cccc(Cl)c1CN1CCCNC2(CCCC2)C1
InChIInChI=1S/C16H22Cl2N2/c17-14-5-3-6-15(18)13(14)11-20-10-4-9-19-16(12-20)7-1-2-8-16/h3,5-6,19H,1-2,4,7-12H2
InChIKeyDZLHEHCHOUPYGB-UHFFFAOYSA-N
XLogP4.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.27
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

11-[(2,6-dichlorophenyl)methyl]-7,11-diazaspiro[5.6]dodecane
CID 64859040
10-[(2,3-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 107310531
10-[(4-bromophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 64869301
10-[(2-chloro-5-fluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 102620775
(5R)-9-benzyl-1,9-diazaspiro[4.5]decane
CID 86332339
4-[(2,6-difluorophenyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 115882998
10-[(3-methylphenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 64869306
10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 64869501
11-[(2-chloro-4-methylphenyl)methyl]-7,11-diazaspiro[5.6]dodecane
CID 106870402
11-(thiophen-2-ylmethyl)-7,11-diazaspiro[5.6]dodecane
CID 64858031
1-[(2,6-dichlorophenyl)methyl]azepane
CID 22198064
10-(pyridin-3-ylmethyl)-6,10-diazaspiro[4.6]undecane
CID 64871680

Frequently Asked Questions

What is the IUPAC name of 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane (CID 64870099) is 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane is Clc1cccc(Cl)c1CN1CCCNC2(CCCC2)C1.
What is the InChIKey of 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
The InChIKey is DZLHEHCHOUPYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22Cl2N2/c17-14-5-3-6-15(18)13(14)11-20-10-4-9-19-16(12-20)7-1-2-8-16/h3,5-6,19H,1-2,4,7-12H2.
What are the key properties of 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane has a molecular weight of 313.27 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 64870099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).