2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide

C18H22N4O4S — CID 92550749

IUPAC2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide
SMILESCC(=O)Nc1nc(C(=O)Nc2ccccc2OCCN2CCOCC2)cs1
InChIInChI=1S/C18H22N4O4S/c1-13(23)19-18-21-15(12-27-18)17(24)20-14-4-2-3-5-16(14)26-11-8-22-6-9-25-10-7-22/h2-5,12H,6-11H2,1H3,(H,20,24)(H,19,21,23)
InChIKeyCYVXVXGJFHCXHU-UHFFFAOYSA-N
MW390.47 g/mol
LogP2.06
Rot. Bonds7

About 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide

2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide (PubChem CID 92550749) has the molecular formula C18H22N4O4S and a molecular weight of 390.47 g/mol. Its IUPAC name is 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide
PubChem CID92550749
Molecular FormulaC18H22N4O4S
Molecular Weight390.47 g/mol
Exact Mass390.14
IUPAC Name2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide
SMILESCC(=O)Nc1nc(C(=O)Nc2ccccc2OCCN2CCOCC2)cs1
InChIInChI=1S/C18H22N4O4S/c1-13(23)19-18-21-15(12-27-18)17(24)20-14-4-2-3-5-16(14)26-11-8-22-6-9-25-10-7-22/h2-5,12H,6-11H2,1H3,(H,20,24)(H,19,21,23)
InChIKeyCYVXVXGJFHCXHU-UHFFFAOYSA-N
XLogP2.06
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.47
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 166210291
2-acetamido-N-[2-[[(2S)-oxolan-2-yl]methoxy]phenyl]-1,3-thiazole-4-carboxamide
CID 51583421
N-(2-acetamidophenyl)-2-morpholin-4-yl-6-(2-morpholin-4-ylethoxy)pyrimidine-4-carboxamide
CID 11634188
2-(2-aminoethyl)-N-[2-(2-morpholin-4-yl-2-oxoethoxy)phenyl]-1,3-thiazole-4-carboxamide;hydrochloride
CID 120637855
N-[2-[2-(4-methylpiperazin-1-yl)ethoxy]phenyl]thiophene-3-carboxamide
CID 56782304
2-morpholin-4-ylethyl N-(2-methoxyphenyl)carbamate
CID 3087022
2-ethoxy-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]benzamide
CID 30547705
N-(2-methoxyphenyl)-1-(2-morpholin-4-ylethyl)-6-oxopyridine-3-carboxamide
CID 53040738
4-N-(2-ethoxyphenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045923
2-[(3,5-dimethoxybenzoyl)amino]-N-(2-ethoxyphenyl)-1,3-thiazole-4-carboxamide
CID 16915265
2-[(4-methoxybenzoyl)amino]-N-(3-morpholin-4-ylpropyl)-1,3-thiazole-4-carboxamide
CID 84555624
N-(2-morpholin-4-ylethyl)-2-[[2-(trifluoromethyl)benzoyl]amino]-1,3-thiazole-4-carboxamide
CID 46114179

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide (CID 92550749) is 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide is CC(=O)Nc1nc(C(=O)Nc2ccccc2OCCN2CCOCC2)cs1.
What is the InChIKey of 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide?
The InChIKey is CYVXVXGJFHCXHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O4S/c1-13(23)19-18-21-15(12-27-18)17(24)20-14-4-2-3-5-16(14)26-11-8-22-6-9-25-10-7-22/h2-5,12H,6-11H2,1H3,(H,20,24)(H,19,21,23).
What are the key properties of 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide?
2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide has a molecular weight of 390.47 g/mol, XLogP of 2.06, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[2-(2-morpholin-4-ylethoxy)phenyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 92550749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).