1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine

C13H19N5 — CID 82384860

IUPAC1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine
SMILESCN1CCC(N)CC1c1cnc2ccn(C)c2n1
InChIInChI=1S/C13H19N5/c1-17-5-3-9(14)7-12(17)11-8-15-10-4-6-18(2)13(10)16-11/h4,6,8-9,12H,3,5,7,14H2,1-2H3
InChIKeyIIMKHINCANBZPZ-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.06
Rot. Bonds1

About 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine

1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine (PubChem CID 82384860) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine
PubChem CID82384860
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine
SMILESCN1CCC(N)CC1c1cnc2ccn(C)c2n1
InChIInChI=1S/C13H19N5/c1-17-5-3-9(14)7-12(17)11-8-15-10-4-6-18(2)13(10)16-11/h4,6,8-9,12H,3,5,7,14H2,1-2H3
InChIKeyIIMKHINCANBZPZ-UHFFFAOYSA-N
XLogP1.06
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-2-(1,2-oxazol-5-yl)piperidin-4-amine
CID 82408264
1-methyl-2-(5-methylimidazo[1,2-a]pyridin-2-yl)piperidin-4-amine
CID 82385489
5-methyl-3-propan-2-ylpyrrolo[2,3-b]pyrazine
CID 178008387
1-methyl-2-(2-methyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-yl)piperidin-4-amine
CID 82384304
1-methyl-2-([1,3]thiazolo[5,4-b]pyridin-7-yl)piperidin-4-amine
CID 82383276
2-(4-chloro-3-methylphenyl)-1-methylpiperidin-4-amine
CID 165457750
1-methyl-2-(7-methyl-1H-indazol-5-yl)piperidin-4-amine
CID 82385475
1-methyl-2-thieno[3,2-d][1,2]thiazol-3-ylpiperidin-4-amine
CID 82381742
1-(1-methylpyrrolo[3,2-b]pyridin-7-yl)piperidin-3-amine
CID 83840471
1-methyl-2-thieno[2,3-d][1,3]dioxol-5-ylpiperidin-4-amine
CID 82387787
3-[4-(4-quinoxalin-2-ylpyrazol-1-yl)piperidin-1-yl]cyclopentan-1-amine
CID 170778255
2-chloro-5-methylpyrrolo[2,3-b]pyrazine
CID 118988246

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine?
The IUPAC name of 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine (CID 82384860) is 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine?
The canonical SMILES for 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine is CN1CCC(N)CC1c1cnc2ccn(C)c2n1.
What is the InChIKey of 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine?
The InChIKey is IIMKHINCANBZPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-17-5-3-9(14)7-12(17)11-8-15-10-4-6-18(2)13(10)16-11/h4,6,8-9,12H,3,5,7,14H2,1-2H3.
What are the key properties of 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine?
1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine has a molecular weight of 245.33 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-(5-methylpyrrolo[2,3-b]pyrazin-3-yl)piperidin-4-amine is sourced from PubChem (CID 82384860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).