N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine

C18H22N6 — CID 125015187

IUPACN,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine
SMILESCN(C)c1nc([C@H]2CCCN(c3cnccn3)C2)cn2cccc12
InChIInChI=1S/C18H22N6/c1-22(2)18-16-6-4-9-23(16)13-15(21-18)14-5-3-10-24(12-14)17-11-19-7-8-20-17/h4,6-9,11,13-14H,3,5,10,12H2,1-2H3/t14-/m0/s1
InChIKeyWRSFGFUILNJLDZ-AWEZNQCLSA-N
MW322.42 g/mol
LogP2.57
Rot. Bonds3

About N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine

N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine (PubChem CID 125015187) has the molecular formula C18H22N6 and a molecular weight of 322.42 g/mol. Its IUPAC name is N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine
PubChem CID125015187
Molecular FormulaC18H22N6
Molecular Weight322.42 g/mol
Exact Mass322.19
IUPAC NameN,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine
SMILESCN(C)c1nc([C@H]2CCCN(c3cnccn3)C2)cn2cccc12
InChIInChI=1S/C18H22N6/c1-22(2)18-16-6-4-9-23(16)13-15(21-18)14-5-3-10-24(12-14)17-11-19-7-8-20-17/h4,6-9,11,13-14H,3,5,10,12H2,1-2H3/t14-/m0/s1
InChIKeyWRSFGFUILNJLDZ-AWEZNQCLSA-N
XLogP2.57
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.42
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine with MolForge

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Related Compounds

N,N-dimethyl-3-[(3R)-1-(2-methylpyrimidin-4-yl)piperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine
CID 125011669
N,N-dimethyl-3-[(2R)-1-(pyrazin-2-ylmethyl)pyrrolidin-2-yl]pyrrolo[1,2-a]pyrazin-1-amine
CID 125009007
2-[(3S)-3-pyridin-2-ylpiperidin-1-yl]pyrazine
CID 95817344
N-methyl-6-(1-pyrazin-2-ylpiperidin-3-yl)pyridin-2-amine
CID 110269026
N-methyl-6-[(3R)-1-pyrazin-2-ylpiperidin-3-yl]pyrazin-2-amine
CID 95840808
N-methyl-3-[1-(pyrazin-2-ylmethyl)piperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine
CID 110100236
N-[6-(1-pyrazin-2-ylpiperidin-3-yl)-2-pyridinyl]pyrimidin-2-amine
CID 110269836
N,N-dimethyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095072
[(3R)-3-[1-(dimethylamino)pyrrolo[1,2-a]pyrazin-3-yl]pyrrolidin-1-yl]-(6-methyl-2-pyridinyl)methanone
CID 125010216
N,N,2-trimethyl-6-[(3S)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine
CID 95824032
3-[6-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]-2-pyridinyl]propanoic acid
CID 95827209
(3S)-N-methyl-1-pyrazin-2-ylpiperidin-3-amine
CID 94476433

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine?
The IUPAC name of N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine (CID 125015187) is N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine.
What is the SMILES notation for N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine?
The canonical SMILES for N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine is CN(C)c1nc([C@H]2CCCN(c3cnccn3)C2)cn2cccc12.
What is the InChIKey of N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine?
The InChIKey is WRSFGFUILNJLDZ-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H22N6/c1-22(2)18-16-6-4-9-23(16)13-15(21-18)14-5-3-10-24(12-14)17-11-19-7-8-20-17/h4,6-9,11,13-14H,3,5,10,12H2,1-2H3/t14-/m0/s1.
What are the key properties of N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine?
N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine has a molecular weight of 322.42 g/mol, XLogP of 2.57, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[(3S)-1-pyrazin-2-ylpiperidin-3-yl]pyrrolo[1,2-a]pyrazin-1-amine is sourced from PubChem (CID 125015187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).