2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]

C11H16N2 — CID 144651313

IUPAC2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]
SMILESCN1CC2=CCC=CN2CC12CC2
InChIInChI=1S/C11H16N2/c1-12-8-10-4-2-3-7-13(10)9-11(12)5-6-11/h3-4,7H,2,5-6,8-9H2,1H3
InChIKeyDXDLQHPTWUHVLJ-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.57
Rot. Bonds

About 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]

2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane] (PubChem CID 144651313) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane].

Molecular Properties

Compound Name2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]
PubChem CID144651313
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]
SMILESCN1CC2=CCC=CN2CC12CC2
InChIInChI=1S/C11H16N2/c1-12-8-10-4-2-3-7-13(10)9-11(12)5-6-11/h3-4,7H,2,5-6,8-9H2,1H3
InChIKeyDXDLQHPTWUHVLJ-UHFFFAOYSA-N
XLogP1.57
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]?
The IUPAC name of 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane] (CID 144651313) is 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane].
What is the SMILES notation for 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]?
The canonical SMILES for 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane] is CN1CC2=CCC=CN2CC12CC2.
What is the InChIKey of 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]?
The InChIKey is DXDLQHPTWUHVLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-12-8-10-4-2-3-7-13(10)9-11(12)5-6-11/h3-4,7H,2,5-6,8-9H2,1H3.
What are the key properties of 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane]?
2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane] has a molecular weight of 176.26 g/mol, XLogP of 1.57, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylspiro[4,8-dihydro-1H-pyrido[1,2-a]pyrazine-3,1'-cyclopropane] is sourced from PubChem (CID 144651313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).