N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide

C18H24N4O2S — CID 91784573

IUPACN-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide
SMILESNc1nc(CCNC(=O)CC2CN(Cc3ccccc3)CCO2)cs1
InChIInChI=1S/C18H24N4O2S/c19-18-21-15(13-25-18)6-7-20-17(23)10-16-12-22(8-9-24-16)11-14-4-2-1-3-5-14/h1-5,13,16H,6-12H2,(H2,19,21)(H,20,23)
InChIKeyFUJOIUUANBLQRI-UHFFFAOYSA-N
MW360.48 g/mol
LogP1.68
Rot. Bonds7

About N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide

N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide (PubChem CID 91784573) has the molecular formula C18H24N4O2S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide.

Molecular Properties

Compound NameN-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide
PubChem CID91784573
Molecular FormulaC18H24N4O2S
Molecular Weight360.48 g/mol
Exact Mass360.16
IUPAC NameN-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide
SMILESNc1nc(CCNC(=O)CC2CN(Cc3ccccc3)CCO2)cs1
InChIInChI=1S/C18H24N4O2S/c19-18-21-15(13-25-18)6-7-20-17(23)10-16-12-22(8-9-24-16)11-14-4-2-1-3-5-14/h1-5,13,16H,6-12H2,(H2,19,21)(H,20,23)
InChIKeyFUJOIUUANBLQRI-UHFFFAOYSA-N
XLogP1.68
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-aminoethyl)-2-(4-benzylmorpholin-2-yl)acetamide
CID 119383303
2-[(2S)-4-benzylmorpholin-2-yl]-N-[2-(4,5-dimethyl-1,3-thiazol-2-yl)ethyl]acetamide
CID 124588180
2-[(2S)-4-benzylmorpholin-2-yl]-N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]acetamide
CID 124844827
2-(4-benzylmorpholin-2-yl)-N-(3-hydroxybutyl)acetamide
CID 111539052
2-(4-benzylmorpholin-2-yl)-N-[2-(cycloheptylamino)ethyl]acetamide
CID 119620021
4-[[[2-[(2R)-4-benzylmorpholin-2-yl]acetyl]amino]methyl]benzoic acid
CID 124703826
N-(3-amino-2-methylpropyl)-2-(4-benzylmorpholin-2-yl)acetamide
CID 119995447
N-[[(2S)-4-benzylmorpholin-2-yl]methyl]-2-[2-(2-chlorophenyl)-1,3-thiazol-4-yl]acetamide
CID 35054371
2-(4-benzylmorpholin-2-yl)-N-[(6-methyl-3-pyridinyl)methyl]acetamide
CID 71991420
2-(4-benzylmorpholin-2-yl)-N-[1-(1,3-thiazol-2-yl)ethyl]acetamide
CID 71991299
2-(4-benzylmorpholin-2-yl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111540025
3-[[2-(4-benzylmorpholin-2-yl)acetyl]amino]-4-methylbenzamide
CID 136529335

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide?
The IUPAC name of N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide (CID 91784573) is N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide.
What is the SMILES notation for N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide?
The canonical SMILES for N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide is Nc1nc(CCNC(=O)CC2CN(Cc3ccccc3)CCO2)cs1.
What is the InChIKey of N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide?
The InChIKey is FUJOIUUANBLQRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2S/c19-18-21-15(13-25-18)6-7-20-17(23)10-16-12-22(8-9-24-16)11-14-4-2-1-3-5-14/h1-5,13,16H,6-12H2,(H2,19,21)(H,20,23).
What are the key properties of N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide?
N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide has a molecular weight of 360.48 g/mol, XLogP of 1.68, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-amino-1,3-thiazol-4-yl)ethyl]-2-(4-benzylmorpholin-2-yl)acetamide is sourced from PubChem (CID 91784573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).