N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine

C15H25N5 — CID 80854791

IUPACN,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine
SMILESCNc1nc(C)nc(N2CC3CCCN3CC2C)c1C
InChIInChI=1S/C15H25N5/c1-10-8-19-7-5-6-13(19)9-20(10)15-11(2)14(16-4)17-12(3)18-15/h10,13H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyVUWVJACMRAZLNS-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.81
Rot. Bonds2

About N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine

N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine (PubChem CID 80854791) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine
PubChem CID80854791
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine
SMILESCNc1nc(C)nc(N2CC3CCCN3CC2C)c1C
InChIInChI=1S/C15H25N5/c1-10-8-19-7-5-6-13(19)9-20(10)15-11(2)14(16-4)17-12(3)18-15/h10,13H,5-9H2,1-4H3,(H,16,17,18)
InChIKeyVUWVJACMRAZLNS-UHFFFAOYSA-N
XLogP1.81
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine with MolForge

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Launch Full Analysis

Related Compounds

N-ethyl-2,5-dimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine
CID 80838425
6-(2,4-dimethylpiperidin-1-yl)-N,2,5-trimethylpyrimidin-4-amine
CID 80825971
6-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N,2,5-trimethylpyrimidin-4-amine
CID 102729117
N,2,5-trimethyl-6-(2-propan-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80856296
2-(6-chloro-2-ethyl-5-methylpyrimidin-4-yl)-3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 80978874
[6-(1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80914467
[6-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2,5-dimethylpyrimidin-4-yl]hydrazine
CID 80928966
6-[3-(dimethylamino)piperidin-1-yl]-N,2,5-trimethylpyrimidin-4-amine
CID 80856401
5,6-dimethyl-3-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyridazine-4-carbothioamide
CID 79928245
[1-[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]azepan-2-yl]methanol
CID 116640681
4,6-dimethyl-2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyridine-3-carboxylic acid
CID 79929549
5-methyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyridin-3-amine
CID 79940906

Frequently Asked Questions

What is the IUPAC name of N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine?
The IUPAC name of N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine (CID 80854791) is N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine.
What is the SMILES notation for N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine?
The canonical SMILES for N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine is CNc1nc(C)nc(N2CC3CCCN3CC2C)c1C.
What is the InChIKey of N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine?
The InChIKey is VUWVJACMRAZLNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-10-8-19-7-5-6-13(19)9-20(10)15-11(2)14(16-4)17-12(3)18-15/h10,13H,5-9H2,1-4H3,(H,16,17,18).
What are the key properties of N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine?
N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine has a molecular weight of 275.40 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,5-trimethyl-6-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 80854791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).