5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide

C11H16N4O3S — CID 177229924

IUPAC5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide
SMILESCNC(=O)c1nc(C)c(C(=O)NC[C@@H](C)C(N)=O)s1
InChIInChI=1S/C11H16N4O3S/c1-5(8(12)16)4-14-9(17)7-6(2)15-11(19-7)10(18)13-3/h5H,4H2,1-3H3,(H2,12,16)(H,13,18)(H,14,17)/t5-/m1/s1
InChIKeyDVSKWAAXUYYZPN-RXMQYKEDSA-N
MW284.34 g/mol
LogP-0.34
Rot. Bonds5

About 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide

5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide (PubChem CID 177229924) has the molecular formula C11H16N4O3S and a molecular weight of 284.34 g/mol. Its IUPAC name is 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide.

Molecular Properties

Compound Name5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide
PubChem CID177229924
Molecular FormulaC11H16N4O3S
Molecular Weight284.34 g/mol
Exact Mass284.09
IUPAC Name5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide
SMILESCNC(=O)c1nc(C)c(C(=O)NC[C@@H](C)C(N)=O)s1
InChIInChI=1S/C11H16N4O3S/c1-5(8(12)16)4-14-9(17)7-6(2)15-11(19-7)10(18)13-3/h5H,4H2,1-3H3,(H2,12,16)(H,13,18)(H,14,17)/t5-/m1/s1
InChIKeyDVSKWAAXUYYZPN-RXMQYKEDSA-N
XLogP-0.34
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 5-0.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide with MolForge

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Related Compounds

2,4-dimethyl-N-[2-(methylamino)propyl]-1,3-thiazole-5-carboxamide;dihydrochloride
CID 120826574
2-methyl-3-[[4-methyl-2-(2-methylpropyl)-1,3-thiazole-5-carbonyl]amino]propanoic acid
CID 75429423
N-(2-hydroxy-4-methylpentyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 103771231
2-amino-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 45058673
5-N-[(2R)-3-[[(6S)-6-ethyl-5-oxo-1,2,3,11-tetrahydropyrazolo[1,2-b][2,3]benzodiazepin-6-yl]amino]-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide
CID 176866003
5-N-[(2R)-3-[[(6S)-9-chloro-6-deuterio-5-oxo-1,2,3,11-tetrahydropyrazolo[1,2-b][2,3]benzodiazepin-6-yl]amino]-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide
CID 176865996
2-(2-hydrazinyl-2-oxoethyl)-4-methyl-N-(2-methylpropyl)-1,3-thiazole-5-carboxamide
CID 126422555
(2S)-3-[(2-amino-4-methyl-1,3-thiazole-5-carbonyl)amino]-2-hydroxypropanoic acid
CID 107835738
2-amino-N-(2,3-dihydroxypropyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 66168708
N-(2-bromo-3-ethylpentyl)-2,4-dimethyl-1,3-thiazole-5-carboxamide
CID 114168808
2-amino-4-methyl-N-[2-(methylamino)-2-oxoethyl]-1,3-thiazole-5-carboxamide
CID 62794600
2-(4-fluorophenyl)-4-methyl-N-[2-(methylamino)propyl]-1,3-thiazole-5-carboxamide;dihydrochloride
CID 120828278

Frequently Asked Questions

What is the IUPAC name of 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide?
The IUPAC name of 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide (CID 177229924) is 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide.
What is the SMILES notation for 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide?
The canonical SMILES for 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide is CNC(=O)c1nc(C)c(C(=O)NC[C@@H](C)C(N)=O)s1.
What is the InChIKey of 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide?
The InChIKey is DVSKWAAXUYYZPN-RXMQYKEDSA-N. The full InChI is InChI=1S/C11H16N4O3S/c1-5(8(12)16)4-14-9(17)7-6(2)15-11(19-7)10(18)13-3/h5H,4H2,1-3H3,(H2,12,16)(H,13,18)(H,14,17)/t5-/m1/s1.
What are the key properties of 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide?
5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide has a molecular weight of 284.34 g/mol, XLogP of -0.34, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-N-[(2R)-3-amino-2-methyl-3-oxopropyl]-2-N,4-dimethyl-1,3-thiazole-2,5-dicarboxamide is sourced from PubChem (CID 177229924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).