2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide

C12H15N5OS — CID 99954745

IUPAC2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)N[C@H](C)Cc1cnccn1
InChIInChI=1S/C12H15N5OS/c1-7(5-9-6-14-3-4-15-9)16-11(18)10-8(2)17-12(13)19-10/h3-4,6-7H,5H2,1-2H3,(H2,13,17)(H,16,18)/t7-/m1/s1
InChIKeyRECCKGVCDSVLNX-SSDOTTSWSA-N
MW277.35 g/mol
LogP1.18
Rot. Bonds4

About 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide

2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide (PubChem CID 99954745) has the molecular formula C12H15N5OS and a molecular weight of 277.35 g/mol. Its IUPAC name is 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
PubChem CID99954745
Molecular FormulaC12H15N5OS
Molecular Weight277.35 g/mol
Exact Mass277.10
IUPAC Name2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide
SMILESCc1nc(N)sc1C(=O)N[C@H](C)Cc1cnccn1
InChIInChI=1S/C12H15N5OS/c1-7(5-9-6-14-3-4-15-9)16-11(18)10-8(2)17-12(13)19-10/h3-4,6-7H,5H2,1-2H3,(H2,13,17)(H,16,18)/t7-/m1/s1
InChIKeyRECCKGVCDSVLNX-SSDOTTSWSA-N
XLogP1.18
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-N-[2-(pyrazin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 47283805
2-ethyl-4-methyl-N-[2-(pyrazin-2-ylamino)ethyl]-1,3-thiazole-5-carboxamide
CID 49385088
N-(4-methyl-1,3-thiazol-2-yl)-5-pyrrolidin-2-ylpyrazine-2-carboxamide
CID 110271502
2-(ethylamino)-4-methyl-N-(1-pyrazin-2-ylpiperidin-3-yl)-1,3-thiazole-5-carboxamide
CID 77094920
2-(ethylamino)-4-methyl-N-[2-(2-pyrazin-2-yl-1,3-thiazol-4-yl)ethyl]-1,3-thiazole-5-carboxamide
CID 91761119
2,4-dimethyl-N-(1-pyrazin-2-ylpiperidin-4-yl)-1,3-thiazole-5-carboxamide
CID 118791257
[4-[[5-(Methylamino)pyrazin-2-yl]methyl]azepan-1-yl]-(4-methyl-1,3-thiazol-5-yl)methanone
CID 155901969
4-methyl-5-({3-[(4-propyl-1H-1,2,3-triazol-1-yl)methyl]-1-piperidinyl}carbonyl)-1,3-thiazol-2-amine
CID 45250773
N-((2-aminothiazol-4-yl)methyl)-N,3-dimethylpyrazine-2-carboxamide
CID 86661291
(2-amino-4-methyl-1,3-thiazol-5-yl)-[(3R)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]methanone
CID 29183098
(2-amino-4-methyl-1,3-thiazol-5-yl)-[(3S)-3-[(4-propyltriazol-1-yl)methyl]piperidin-1-yl]methanone
CID 29183099
3-amino-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyrazine-2-carboxamide
CID 33263811

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide (CID 99954745) is 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide is Cc1nc(N)sc1C(=O)N[C@H](C)Cc1cnccn1.
What is the InChIKey of 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide?
The InChIKey is RECCKGVCDSVLNX-SSDOTTSWSA-N. The full InChI is InChI=1S/C12H15N5OS/c1-7(5-9-6-14-3-4-15-9)16-11(18)10-8(2)17-12(13)19-10/h3-4,6-7H,5H2,1-2H3,(H2,13,17)(H,16,18)/t7-/m1/s1.
What are the key properties of 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide?
2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide has a molecular weight of 277.35 g/mol, XLogP of 1.18, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-N-[(2R)-1-pyrazin-2-ylpropan-2-yl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 99954745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).