10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane

C16H22F2N2 — CID 64869501

IUPAC10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
SMILESFc1cccc(CN2CCCNC3(CCCC3)C2)c1F
InChIInChI=1S/C16H22F2N2/c17-14-6-3-5-13(15(14)18)11-20-10-4-9-19-16(12-20)7-1-2-8-16/h3,5-6,19H,1-2,4,7-12H2
InChIKeyHYZPNDVYMUDOJX-UHFFFAOYSA-N
MW280.36 g/mol
LogP3.07
Rot. Bonds2

About 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane

10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane (PubChem CID 64869501) has the molecular formula C16H22F2N2 and a molecular weight of 280.36 g/mol. Its IUPAC name is 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
PubChem CID64869501
Molecular FormulaC16H22F2N2
Molecular Weight280.36 g/mol
Exact Mass280.18
IUPAC Name10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
SMILESFc1cccc(CN2CCCNC3(CCCC3)C2)c1F
InChIInChI=1S/C16H22F2N2/c17-14-6-3-5-13(15(14)18)11-20-10-4-9-19-16(12-20)7-1-2-8-16/h3,5-6,19H,1-2,4,7-12H2
InChIKeyHYZPNDVYMUDOJX-UHFFFAOYSA-N
XLogP3.07
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

10-[(2,3-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 107310531
7-[(2,3-difluorophenyl)methyl]-2,7-diazaspiro[4.5]decane
CID 56909547
4-[(2,6-difluorophenyl)methyl]-1,4-diazaspiro[5.5]undecane
CID 115882998
1-[(2,3-difluorophenyl)methyl]azetidine
CID 126989798
10-[(2-chloro-5-fluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 102620775
10-[(2,6-dichlorophenyl)methyl]-6,10-diazaspiro[4.6]undecane
CID 64870099
9-[(2,3-difluorophenyl)methyl]-8-methyl-6,9-diazaspiro[4.5]decane
CID 64877544
4-[2-(2-fluorophenyl)ethyl]-1,4-diazaspiro[5.5]undecane
CID 64926773
11-[(4-fluoro-2-methylphenyl)methyl]-7,11-diazaspiro[5.6]dodecane
CID 114349619
11-[(2,6-dichlorophenyl)methyl]-7,11-diazaspiro[5.6]dodecane
CID 64859040
4-[(2,3-difluorophenyl)methyl]-3-methyl-1,4-diazaspiro[5.5]undecane
CID 64876835
(5S)-2-[(4-fluorophenyl)methyl]-2,6-diazaspiro[4.5]decane
CID 97305383

Frequently Asked Questions

What is the IUPAC name of 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane (CID 64869501) is 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane is Fc1cccc(CN2CCCNC3(CCCC3)C2)c1F.
What is the InChIKey of 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
The InChIKey is HYZPNDVYMUDOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22F2N2/c17-14-6-3-5-13(15(14)18)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-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane?
10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane has a molecular weight of 280.36 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[(2,3-difluorophenyl)methyl]-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 64869501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).