N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine

C14H19N5S — CID 125005171

IUPACN,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine
SMILESCN(C)c1cncc([C@H]2CCCN2Cc2nccs2)n1
InChIInChI=1S/C14H19N5S/c1-18(2)13-9-15-8-11(17-13)12-4-3-6-19(12)10-14-16-5-7-20-14/h5,7-9,12H,3-4,6,10H2,1-2H3/t12-/m1/s1
InChIKeyTXHPRACESGAUPX-GFCCVEGCSA-N
MW289.41 g/mol
LogP2.34
Rot. Bonds4

About N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine

N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine (PubChem CID 125005171) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine
PubChem CID125005171
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC NameN,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine
SMILESCN(C)c1cncc([C@H]2CCCN2Cc2nccs2)n1
InChIInChI=1S/C14H19N5S/c1-18(2)13-9-15-8-11(17-13)12-4-3-6-19(12)10-14-16-5-7-20-14/h5,7-9,12H,3-4,6,10H2,1-2H3/t12-/m1/s1
InChIKeyTXHPRACESGAUPX-GFCCVEGCSA-N
XLogP2.34
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N,N-dimethyl-6-[(2R)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]pyrrolidin-2-yl]pyrazin-2-amine
CID 124976389
5-methyl-N-[6-[1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-yl]-1,3-thiazol-2-amine
CID 175659672
N,N-dimethyl-1-[2-methyl-4-[(2S)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrimidin-5-yl]methanamine
CID 124969108
2-[(2-pyridin-2-ylpiperidin-1-yl)methyl]-1,3-thiazole
CID 77081994
2-[[2-(1-methyl-4,5,6,7-tetrahydrobenzimidazol-2-yl)pyrrolidin-1-yl]methyl]-1,3-thiazole
CID 128978977
2-[[(2S)-2-(4-fluorophenyl)pyrrolidin-1-yl]methyl]-1,3-thiazole
CID 99947605
2-[(2-imidazo[1,2-a]pyrimidin-7-ylpiperidin-1-yl)methyl]-1,3-thiazole
CID 110118108
2-[[(2R)-2-imidazo[1,2-a]pyrimidin-7-ylpiperidin-1-yl]methyl]-1,3-thiazole
CID 124962159
3,5-dimethyl-4-[4-[1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrimidin-2-yl]-1,2-oxazole
CID 110129440
3,5-dimethyl-4-[4-[(2S)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrimidin-2-yl]-1,2-oxazole
CID 124942382
N-[[6-[(2S)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]-2-pyridinyl]methyl]acetamide
CID 125007878
2-[[(2R)-2-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]-1,3-thiazole
CID 124641351

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine?
The IUPAC name of N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine (CID 125005171) is N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine.
What is the SMILES notation for N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine?
The canonical SMILES for N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine is CN(C)c1cncc([C@H]2CCCN2Cc2nccs2)n1.
What is the InChIKey of N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine?
The InChIKey is TXHPRACESGAUPX-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H19N5S/c1-18(2)13-9-15-8-11(17-13)12-4-3-6-19(12)10-14-16-5-7-20-14/h5,7-9,12H,3-4,6,10H2,1-2H3/t12-/m1/s1.
What are the key properties of N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine?
N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine has a molecular weight of 289.41 g/mol, XLogP of 2.34, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine is sourced from PubChem (CID 125005171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).