N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide

C12H17N5O2S — CID 133359021

IUPACN-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide
SMILESCc1cc(NC(=O)CN(C)c2nc(C(C)C)ns2)no1
InChIInChI=1S/C12H17N5O2S/c1-7(2)11-14-12(20-16-11)17(4)6-10(18)13-9-5-8(3)19-15-9/h5,7H,6H2,1-4H3,(H,13,15,18)
InChIKeyVUNKFGXZDCLGGD-UHFFFAOYSA-N
MW295.37 g/mol
LogP2.03
Rot. Bonds5

About N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide

N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide (PubChem CID 133359021) has the molecular formula C12H17N5O2S and a molecular weight of 295.37 g/mol. Its IUPAC name is N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide.

Molecular Properties

Compound NameN-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide
PubChem CID133359021
Molecular FormulaC12H17N5O2S
Molecular Weight295.37 g/mol
Exact Mass295.11
IUPAC NameN-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide
SMILESCc1cc(NC(=O)CN(C)c2nc(C(C)C)ns2)no1
InChIInChI=1S/C12H17N5O2S/c1-7(2)11-14-12(20-16-11)17(4)6-10(18)13-9-5-8(3)19-15-9/h5,7H,6H2,1-4H3,(H,13,15,18)
InChIKeyVUNKFGXZDCLGGD-UHFFFAOYSA-N
XLogP2.03
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.37
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

(2R)-2-amino-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]propanamide
CID 54996242
2-[methyl(naphthalen-1-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60570476
2-[(4-methoxy-1,3-benzothiazol-2-yl)-methylamino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 90605660
2-amino-N,2-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]propanamide
CID 61265039
2-[acetyl(2-methylpropyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 813520
4-hydroxy-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]pentanamide
CID 79203580
2-amino-N,3-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]pentanamide;hydrochloride
CID 119697260
2-[carboxymethyl-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]amino]acetic acid
CID 55245946
2-amino-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]acetamide
CID 60947011
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 51171141
2-[3-methylbutyl(methylsulfonyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 4105604
2-amino-N,4-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]pentanamide
CID 60947443

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide?
The IUPAC name of N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide (CID 133359021) is N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide.
What is the SMILES notation for N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide?
The canonical SMILES for N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide is Cc1cc(NC(=O)CN(C)c2nc(C(C)C)ns2)no1.
What is the InChIKey of N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide?
The InChIKey is VUNKFGXZDCLGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O2S/c1-7(2)11-14-12(20-16-11)17(4)6-10(18)13-9-5-8(3)19-15-9/h5,7H,6H2,1-4H3,(H,13,15,18).
What are the key properties of N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide?
N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide has a molecular weight of 295.37 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2-oxazol-3-yl)-2-[methyl-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)amino]acetamide is sourced from PubChem (CID 133359021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).