N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

C14H25N3O2S — CID 18160775

IUPACN-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)NCCN(C(C)C)C(C)C
InChIInChI=1S/C14H25N3O2S/c1-10(2)16(11(3)4)7-6-15-13(18)8-17-12(5)9-20-14(17)19/h9-11H,6-8H2,1-5H3,(H,15,18)
InChIKeySWDVTAXCKJITLV-UHFFFAOYSA-N
MW299.44 g/mol
LogP1.45
Rot. Bonds7

About N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 18160775) has the molecular formula C14H25N3O2S and a molecular weight of 299.44 g/mol. Its IUPAC name is N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID18160775
Molecular FormulaC14H25N3O2S
Molecular Weight299.44 g/mol
Exact Mass299.17
IUPAC NameN-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)NCCN(C(C)C)C(C)C
InChIInChI=1S/C14H25N3O2S/c1-10(2)16(11(3)4)7-6-15-13(18)8-17-12(5)9-20-14(17)19/h9-11H,6-8H2,1-5H3,(H,15,18)
InChIKeySWDVTAXCKJITLV-UHFFFAOYSA-N
XLogP1.45
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.44
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cycloheptyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 4963600
N-(2-methylbutan-2-yl)-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 16272650
2-[cyclopentyl(methyl)amino]-2-methyl-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]propanamide
CID 75483316
2-[2-oxo-4-(trifluoromethyl)-1,3-thiazol-3-yl]-N-propan-2-ylacetamide
CID 71979625
N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-2-(2,2,2-trifluoroethylamino)acetamide
CID 103862860
2-[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]-N-(2,2,2-trifluoroethyl)propanamide
CID 106380787
2-[(2-oxo-3H-1,3-thiazol-4-yl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 106380838
N-cyclohexyl-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
CID 4808442
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2-sulfanylethyl)acetamide
CID 177680509
2-(4-methyl-2H-1,3-thiazol-3-yl)acetamide
CID 56980528
N-butan-2-yl-2-oxo-3H-1,3-thiazole-4-carboxamide
CID 123213192
2-oxo-N-propan-2-yl-3H-1,3-thiazole-4-carboxamide
CID 123265507

Frequently Asked Questions

What is the IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (CID 18160775) is N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is Cc1csc(=O)n1CC(=O)NCCN(C(C)C)C(C)C.
What is the InChIKey of N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is SWDVTAXCKJITLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2S/c1-10(2)16(11(3)4)7-6-15-13(18)8-17-12(5)9-20-14(17)19/h9-11H,6-8H2,1-5H3,(H,15,18).
What are the key properties of N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 299.44 g/mol, XLogP of 1.45, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[di(propan-2-yl)amino]ethyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 18160775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).