N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide

C14H24N2O2S — CID 111463295

IUPACN-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCCC(O)(CC)CNC(=O)Cc1csc(C(C)C)n1
InChIInChI=1S/C14H24N2O2S/c1-5-14(18,6-2)9-15-12(17)7-11-8-19-13(16-11)10(3)4/h8,10,18H,5-7,9H2,1-4H3,(H,15,17)
InChIKeyBYUVKVOYCOSXQV-UHFFFAOYSA-N
MW284.43 g/mol
LogP2.48
Rot. Bonds7

About N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide

N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide (PubChem CID 111463295) has the molecular formula C14H24N2O2S and a molecular weight of 284.43 g/mol. Its IUPAC name is N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
PubChem CID111463295
Molecular FormulaC14H24N2O2S
Molecular Weight284.43 g/mol
Exact Mass284.16
IUPAC NameN-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
SMILESCCC(O)(CC)CNC(=O)Cc1csc(C(C)C)n1
InChIInChI=1S/C14H24N2O2S/c1-5-14(18,6-2)9-15-12(17)7-11-8-19-13(16-11)10(3)4/h8,10,18H,5-7,9H2,1-4H3,(H,15,17)
InChIKeyBYUVKVOYCOSXQV-UHFFFAOYSA-N
XLogP2.48
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.43
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 91286036
ethyl 2-(2-propan-2-yl-1,3-thiazol-4-yl)acetate
CID 10727325
N-[(4-tert-butylphenyl)methyl]-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 90758793
N-(1-hydroxypropan-2-yl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 110890212
ethyl 2-[[2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]acetyl]amino]acetate
CID 82547812
N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]butanamide
CID 110728040
2-(2-propan-2-yl-1,3-thiazol-4-yl)-N-[3-(2,2,2-trifluoroethoxy)propyl]acetamide
CID 86986102
ethyl 2-[[2-[2-(1-amino-2-methylpropyl)-1,3-thiazol-4-yl]acetyl]amino]acetate
CID 82547809
N-(furan-3-ylmethyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 47056486
N-(1,1-diphenylethyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 56522612
1-N,4-N-bis[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]benzene-1,4-dicarboxamide
CID 56561374
2-chloro-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
CID 166403785

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
The IUPAC name of N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide (CID 111463295) is N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide.
What is the SMILES notation for N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
The canonical SMILES for N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide is CCC(O)(CC)CNC(=O)Cc1csc(C(C)C)n1.
What is the InChIKey of N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
The InChIKey is BYUVKVOYCOSXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S/c1-5-14(18,6-2)9-15-12(17)7-11-8-19-13(16-11)10(3)4/h8,10,18H,5-7,9H2,1-4H3,(H,15,17).
What are the key properties of N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide?
N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide has a molecular weight of 284.43 g/mol, XLogP of 2.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyl-2-hydroxybutyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide is sourced from PubChem (CID 111463295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).