2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide

C18H24N4O2S — CID 120640463

IUPAC2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide
SMILESNCCc1nc(C(=O)NC(CN2CCOCC2)c2ccccc2)cs1
InChIInChI=1S/C18H24N4O2S/c19-7-6-17-20-16(13-25-17)18(23)21-15(14-4-2-1-3-5-14)12-22-8-10-24-11-9-22/h1-5,13,15H,6-12,19H2,(H,21,23)
InChIKeyJGFYGKNKFYNMOA-UHFFFAOYSA-N
MW360.48 g/mol
LogP1.45
Rot. Bonds7

About 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide

2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide (PubChem CID 120640463) has the molecular formula C18H24N4O2S and a molecular weight of 360.48 g/mol. Its IUPAC name is 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide
PubChem CID120640463
Molecular FormulaC18H24N4O2S
Molecular Weight360.48 g/mol
Exact Mass360.16
IUPAC Name2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide
SMILESNCCc1nc(C(=O)NC(CN2CCOCC2)c2ccccc2)cs1
InChIInChI=1S/C18H24N4O2S/c19-7-6-17-20-16(13-25-17)18(23)21-15(14-4-2-1-3-5-14)12-22-8-10-24-11-9-22/h1-5,13,15H,6-12,19H2,(H,21,23)
InChIKeyJGFYGKNKFYNMOA-UHFFFAOYSA-N
XLogP1.45
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 ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(1R)-2-morpholin-4-yl-1-phenylethyl]-2-thiophen-3-yl-1,3-thiazole-4-carboxamide
CID 9150618
2-[[2-(2-aminoethyl)-1,3-thiazole-4-carbonyl]amino]-2-phenylacetic acid
CID 66390847
N-(2-morpholin-4-yl-1-phenylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 45132972
2-(2-aminoethyl)-N-[2-(morpholin-4-ylmethyl)phenyl]-1,3-thiazole-4-carboxamide;dihydrochloride
CID 120644858
[(1S)-2-morpholin-4-yl-1-phenylethyl]carbamic acid
CID 68931667
2-(2-aminoethyl)-N-[oxolan-2-yl(phenyl)methyl]-1,3-thiazole-4-carboxamide
CID 120627358
2-(aminomethyl)-N-[2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]-1,3-thiazole-4-carboxamide
CID 119719349
2-fluoro-N-[(1R)-2-morpholin-4-yl-1-phenylethyl]benzamide
CID 9149743
2-hydroxy-N-(2-morpholin-4-yl-1-phenylethyl)benzamide
CID 86918289
2-(2-aminoethyl)-N-(1-piperidin-1-ylpropan-2-yl)-1,3-thiazole-4-carboxamide
CID 66388857
2-(2-aminoethyl)-N-[2-(4-methylphenyl)-2-morpholin-4-ylethyl]-1,3-thiazole-4-carboxamide
CID 120644919
2-(2-aminoethyl)-N-[2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-1,3-thiazole-4-carboxamide
CID 120639799

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide (CID 120640463) is 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide is NCCc1nc(C(=O)NC(CN2CCOCC2)c2ccccc2)cs1.
What is the InChIKey of 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide?
The InChIKey is JGFYGKNKFYNMOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O2S/c19-7-6-17-20-16(13-25-17)18(23)21-15(14-4-2-1-3-5-14)12-22-8-10-24-11-9-22/h1-5,13,15H,6-12,19H2,(H,21,23).
What are the key properties of 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide?
2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide has a molecular weight of 360.48 g/mol, XLogP of 1.45, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethyl)-N-(2-morpholin-4-yl-1-phenylethyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 120640463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).