4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide

C14H18N4O2S — CID 116667999

IUPAC4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide
SMILESCCOc1ccc(NC(=O)c2sc(N(C)C)nc2N)cc1
InChIInChI=1S/C14H18N4O2S/c1-4-20-10-7-5-9(6-8-10)16-13(19)11-12(15)17-14(21-11)18(2)3/h5-8H,4,15H2,1-3H3,(H,16,19)
InChIKeyGZBVDAKAMJKBHZ-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.44
Rot. Bonds5

About 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide

4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide (PubChem CID 116667999) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide
PubChem CID116667999
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC Name4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide
SMILESCCOc1ccc(NC(=O)c2sc(N(C)C)nc2N)cc1
InChIInChI=1S/C14H18N4O2S/c1-4-20-10-7-5-9(6-8-10)16-13(19)11-12(15)17-14(21-11)18(2)3/h5-8H,4,15H2,1-3H3,(H,16,19)
InChIKeyGZBVDAKAMJKBHZ-UHFFFAOYSA-N
XLogP2.44
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.39
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-amino-N-(1,3-benzothiazol-6-yl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 107806799
4-amino-2-[ethyl(methyl)amino]-N-(4-methylphenyl)-1,3-thiazole-5-carboxamide
CID 116668817
4-amino-2-(dimethylamino)-N-(4-fluoro-3-methylphenyl)-1,3-thiazole-5-carboxamide
CID 116665584
4-amino-N-(3-chlorophenyl)-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116668442
4-amino-2-[methyl(propyl)amino]-N-(6-methyl-3-pyridinyl)-1,3-thiazole-5-carboxamide
CID 116671678
4-amino-2-(dimethylamino)-N-(2-ethoxyethyl)-1,3-thiazole-5-carboxamide
CID 116670447
3-amino-N-(4-ethoxyphenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 734377
N-(4-ethoxyphenyl)-4,5-dimethyl-1,3-thiazole-2-carboxamide
CID 110696380
4-amino-N-[2-(diethylamino)-2-oxoethyl]-2-(dimethylamino)-1,3-thiazole-5-carboxamide
CID 116672594
3-chloro-N-(4-ethoxyphenyl)-6-hydrazinylpyridine-2-carboxamide
CID 62233417
2-amino-N-[4-(2-methoxyethoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxamide
CID 62793426
3-amino-N-(4-ethoxyphenyl)-6-(2-methylpropyl)thieno[2,3-b]pyridine-2-carboxamide
CID 23745634

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide (CID 116667999) is 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide is CCOc1ccc(NC(=O)c2sc(N(C)C)nc2N)cc1.
What is the InChIKey of 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide?
The InChIKey is GZBVDAKAMJKBHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c1-4-20-10-7-5-9(6-8-10)16-13(19)11-12(15)17-14(21-11)18(2)3/h5-8H,4,15H2,1-3H3,(H,16,19).
What are the key properties of 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide?
4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide has a molecular weight of 306.39 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-(dimethylamino)-N-(4-ethoxyphenyl)-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116667999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).