2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide

C15H20N4OS — CID 57250739

IUPAC2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide
SMILESCCNc1cnc(NC(=O)Cc2ccc(N(C)C)cc2)s1
InChIInChI=1S/C15H20N4OS/c1-4-16-14-10-17-15(21-14)18-13(20)9-11-5-7-12(8-6-11)19(2)3/h5-8,10,16H,4,9H2,1-3H3,(H,17,18,20)
InChIKeyMRUQHSZNBQMHDE-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.82
Rot. Bonds6

About 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide

2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide (PubChem CID 57250739) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide
PubChem CID57250739
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC Name2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide
SMILESCCNc1cnc(NC(=O)Cc2ccc(N(C)C)cc2)s1
InChIInChI=1S/C15H20N4OS/c1-4-16-14-10-17-15(21-14)18-13(20)9-11-5-7-12(8-6-11)19(2)3/h5-8,10,16H,4,9H2,1-3H3,(H,17,18,20)
InChIKeyMRUQHSZNBQMHDE-UHFFFAOYSA-N
XLogP2.82
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

N-(5-amino-1,3-thiazol-2-yl)-2-[4-(dimethylamino)phenyl]acetamide
CID 22678824
N-(5-bromo-1,3-thiazol-2-yl)-2-(4-methoxyphenyl)acetamide
CID 22170781
methyl 2-[[2-(4-methylphenyl)acetyl]amino]-1,3-thiazole-5-carboxylate
CID 18103773
N-[4-(dimethylamino)phenyl]-2-phenylacetamide
CID 4095589
N-[5-[4-(dimethylamino)anilino]-2-pyridinyl]-2-phenylacetamide
CID 113035518
methyl 2-[[2-(4-pyrrol-1-ylphenyl)acetyl]amino]-1,3-thiazole-5-carboxylate
CID 31911755
N-[5-[(4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-2-(4-methylphenyl)acetamide
CID 60600982
N-(5-bromo-1,3-thiazol-2-yl)propanamide
CID 60654828
2-(4-nitrophenyl)-N-(5-nitro-1,3-thiazol-2-yl)acetamide
CID 3390048
N-(5-cyano-1,3-thiazol-2-yl)-2-(4-fluorophenyl)acetamide
CID 90603616
2-[4-(dimethylamino)phenyl]-N-[1-(1,3-thiazol-2-yl)propyl]acetamide
CID 91765781
2-[4-[(2-aminoacetyl)amino]phenyl]-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 10131664

Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide?
The IUPAC name of 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide (CID 57250739) is 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide is CCNc1cnc(NC(=O)Cc2ccc(N(C)C)cc2)s1.
What is the InChIKey of 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide?
The InChIKey is MRUQHSZNBQMHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-4-16-14-10-17-15(21-14)18-13(20)9-11-5-7-12(8-6-11)19(2)3/h5-8,10,16H,4,9H2,1-3H3,(H,17,18,20).
What are the key properties of 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide?
2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide has a molecular weight of 304.42 g/mol, XLogP of 2.82, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)phenyl]-N-[5-(ethylamino)-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 57250739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).