2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine

C10H18F2N2 — CID 146528968

IUPAC2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine
SMILESCCN1CCN2CCC(F)(F)CC2C1
InChIInChI=1S/C10H18F2N2/c1-2-13-5-6-14-4-3-10(11,12)7-9(14)8-13/h9H,2-8H2,1H3
InChIKeyHSLLVDWTNREEQS-UHFFFAOYSA-N
MW204.26 g/mol
LogP1.42
Rot. Bonds1

About 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine

2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine (PubChem CID 146528968) has the molecular formula C10H18F2N2 and a molecular weight of 204.26 g/mol. Its IUPAC name is 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine.

Molecular Properties

Compound Name2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine
PubChem CID146528968
Molecular FormulaC10H18F2N2
Molecular Weight204.26 g/mol
Exact Mass204.14
IUPAC Name2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine
SMILESCCN1CCN2CCC(F)(F)CC2C1
InChIInChI=1S/C10H18F2N2/c1-2-13-5-6-14-4-3-10(11,12)7-9(14)8-13/h9H,2-8H2,1H3
InChIKeyHSLLVDWTNREEQS-UHFFFAOYSA-N
XLogP1.42
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.26
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine 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

1-(1-ethylazetidin-3-yl)-4-(2-methylpropyl)piperazine
CID 156885108
(9aS)-8-ethyl-2-methylsulfanyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine
CID 142537841
7-ethyl-1,3,5,6,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyrazine
CID 59534690
1-(1-ethylazetidin-3-yl)piperidine
CID 69087799
(2R)-1-ethyl-4,4-difluoro-2-methylpiperidine
CID 174261400
(2S)-1-ethyl-4,4-difluoro-2-methylpiperidine
CID 156560046
1-ethyl-4,4-difluoropiperidin-3-ol
CID 130634849
ethane;9-(4-ethylpiperazin-1-yl)-3-azaspiro[5.5]undecane
CID 171641602
2-ethyl-7-methoxy-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 142312917
1,2-diethyl-4,4-difluoropiperidine
CID 177032235
[(3R)-1-ethyl-4,4-difluoropiperidin-3-yl]phosphane
CID 174264008
[1-amino-3-(4-ethylpiperazin-1-yl)cyclopentyl]methanol
CID 79656436

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine?
The IUPAC name of 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine (CID 146528968) is 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine.
What is the SMILES notation for 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine?
The canonical SMILES for 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine is CCN1CCN2CCC(F)(F)CC2C1.
What is the InChIKey of 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine?
The InChIKey is HSLLVDWTNREEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2/c1-2-13-5-6-14-4-3-10(11,12)7-9(14)8-13/h9H,2-8H2,1H3.
What are the key properties of 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine?
2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine has a molecular weight of 204.26 g/mol, XLogP of 1.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-8,8-difluoro-3,4,6,7,9,9a-hexahydro-1H-pyrido[1,2-a]pyrazine is sourced from PubChem (CID 146528968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).