4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide

C14H18N4O2S — CID 116665055

IUPAC4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide
SMILESCCNc1nc(N)c(C(=O)N(C)c2cccc(OC)c2)s1
InChIInChI=1S/C14H18N4O2S/c1-4-16-14-17-12(15)11(21-14)13(19)18(2)9-6-5-7-10(8-9)20-3/h5-8H,4,15H2,1-3H3,(H,16,17)
InChIKeyYODWICXYIINWIU-UHFFFAOYSA-N
MW306.39 g/mol
LogP2.44
Rot. Bonds5

About 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide

4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide (PubChem CID 116665055) has the molecular formula C14H18N4O2S and a molecular weight of 306.39 g/mol. Its IUPAC name is 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide
PubChem CID116665055
Molecular FormulaC14H18N4O2S
Molecular Weight306.39 g/mol
Exact Mass306.12
IUPAC Name4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide
SMILESCCNc1nc(N)c(C(=O)N(C)c2cccc(OC)c2)s1
InChIInChI=1S/C14H18N4O2S/c1-4-16-14-17-12(15)11(21-14)13(19)18(2)9-6-5-7-10(8-9)20-3/h5-8H,4,15H2,1-3H3,(H,16,17)
InChIKeyYODWICXYIINWIU-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-2-(ethylamino)-N-(2-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide
CID 116665052
2-(methanesulfonamido)-N-(3-methoxyphenyl)-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 100772871
4-amino-2-(ethylamino)-N-methyl-N-(2-methylbutan-2-yl)-1,3-thiazole-5-carboxamide
CID 116666497
4-amino-2-(tert-butylamino)-N-methyl-N-pyridin-3-yl-1,3-thiazole-5-carboxamide
CID 116666650
4-amino-2-(ethylamino)-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazole-5-carboxamide
CID 116664355
4-amino-N-ethyl-2-(ethylamino)-N-(4-methylphenyl)-1,3-thiazole-5-carboxamide
CID 116665070
4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 23508483
4-amino-2-(ethylamino)-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-carboxamide
CID 116670593
4-amino-N-[(4-bromothiophen-2-yl)methyl]-2-(ethylamino)-N-methyl-1,3-thiazole-5-carboxamide
CID 116664190
2-amino-4-methoxy-N-(3-methoxyphenyl)-N-methylbenzamide
CID 115413114
3-amino-N-(3-methoxyphenyl)-N,2,2,3-tetramethylbutanamide
CID 65267204
N-ethyl-5-[(3-methoxy-N-methylanilino)methyl]-1,3,4-thiadiazol-2-amine
CID 80606393

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide (CID 116665055) is 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide is CCNc1nc(N)c(C(=O)N(C)c2cccc(OC)c2)s1.
What is the InChIKey of 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is YODWICXYIINWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2S/c1-4-16-14-17-12(15)11(21-14)13(19)18(2)9-6-5-7-10(8-9)20-3/h5-8H,4,15H2,1-3H3,(H,16,17).
What are the key properties of 4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide?
4-amino-2-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-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-(ethylamino)-N-(3-methoxyphenyl)-N-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 116665055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).