6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane

C14H19F2N3 — CID 121229504

IUPAC6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
SMILESFC1(F)CCNCC12CCN(Cc1ccccn1)C2
InChIInChI=1S/C14H19F2N3/c15-14(16)4-7-17-10-13(14)5-8-19(11-13)9-12-3-1-2-6-18-12/h1-3,6,17H,4-5,7-11H2
InChIKeyJMBCMQUCONSDMW-UHFFFAOYSA-N
MW267.32 g/mol
LogP1.90
Rot. Bonds2

About 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane

6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane (PubChem CID 121229504) has the molecular formula C14H19F2N3 and a molecular weight of 267.32 g/mol. Its IUPAC name is 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
PubChem CID121229504
Molecular FormulaC14H19F2N3
Molecular Weight267.32 g/mol
Exact Mass267.15
IUPAC Name6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
SMILESFC1(F)CCNCC12CCN(Cc1ccccn1)C2
InChIInChI=1S/C14H19F2N3/c15-14(16)4-7-17-10-13(14)5-8-19(11-13)9-12-3-1-2-6-18-12/h1-3,6,17H,4-5,7-11H2
InChIKeyJMBCMQUCONSDMW-UHFFFAOYSA-N
XLogP1.90
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane 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

(5R)-6,6-difluoro-2-pyrazin-2-yl-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 97374447
ethane;1-(pyridin-2-ylmethyl)-1,4,7,10-tetrazacyclododecane
CID 171786933
2,9-bis(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 131649183
piperazine;1-(pyridin-2-ylmethyl)piperazine
CID 174820345
6,6-difluoro-2-pyridin-3-yl-9-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane;bis(2,2,2-trifluoroacetic acid)
CID 171685860
1-(pyridin-2-ylmethyl)piperidine-4,4-dicarbonitrile
CID 117007901
methanamine;1-(pyridin-2-ylmethyl)piperazine
CID 142253020
2-[(4,4-difluoro-3-methylpiperidin-1-yl)methyl]pyridine
CID 126771656
6,6-difluoro-2-pyridin-2-yl-9-(pyridin-4-ylmethyl)-2,9-diazaspiro[4.5]decane
CID 131642876
3-methyl-1-(pyridin-2-ylmethyl)piperidin-3-ol
CID 115873664
1'-(pyridin-2-ylmethyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 97375615
2-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-2,8-diazaspiro[4.5]decane
CID 120906669

Frequently Asked Questions

What is the IUPAC name of 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
The IUPAC name of 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane (CID 121229504) is 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane.
What is the SMILES notation for 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
The canonical SMILES for 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane is FC1(F)CCNCC12CCN(Cc1ccccn1)C2.
What is the InChIKey of 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
The InChIKey is JMBCMQUCONSDMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2N3/c15-14(16)4-7-17-10-13(14)5-8-19(11-13)9-12-3-1-2-6-18-12/h1-3,6,17H,4-5,7-11H2.
What are the key properties of 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane?
6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane has a molecular weight of 267.32 g/mol, XLogP of 1.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-difluoro-2-(pyridin-2-ylmethyl)-2,9-diazaspiro[4.5]decane is sourced from PubChem (CID 121229504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).