N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide

C14H17N3O2S — CID 810478

IUPACN-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide
SMILESCCNc1nc(-c2cccc(NC(=O)COC)c2)cs1
InChIInChI=1S/C14H17N3O2S/c1-3-15-14-17-12(9-20-14)10-5-4-6-11(7-10)16-13(18)8-19-2/h4-7,9H,3,8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyHNRCXGDBKKMBSI-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.83
Rot. Bonds6

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

N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide (PubChem CID 810478) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide
PubChem CID810478
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide
SMILESCCNc1nc(-c2cccc(NC(=O)COC)c2)cs1
InChIInChI=1S/C14H17N3O2S/c1-3-15-14-17-12(9-20-14)10-5-4-6-11(7-10)16-13(18)8-19-2/h4-7,9H,3,8H2,1-2H3,(H,15,17)(H,16,18)
InChIKeyHNRCXGDBKKMBSI-UHFFFAOYSA-N
XLogP2.83
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[3-(2-piperidin-1-yl-1,3-thiazol-4-yl)phenyl]acetamide
CID 810541
N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-1,3-benzodioxole-5-carboxamide
CID 42764774
2-amino-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 43218994
2-(4-methoxyphenyl)-N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 852161
N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-4-methyl-3-nitrobenzamide
CID 5154094
2-methoxy-N-[3-(5-methyl-1H-1,2,4-triazol-3-yl)phenyl]acetamide
CID 60911506
ethyl 1-[[4-[3-[(2-methoxyacetyl)amino]phenyl]-1,3-thiazol-2-yl]methyl]pyrazole-4-carboxylate
CID 58127684
N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-2-methoxyacetamide
CID 51185945
2-methoxy-N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]acetamide
CID 51239098
2-methyl-N-[3-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]phenyl]propanamide
CID 5100026
N-[3-[2-(butanoylamino)-1,3-thiazol-4-yl]phenyl]-3,4,5-trimethoxybenzamide
CID 4000067
[2-[3-(2-methyl-1,3-thiazol-4-yl)anilino]-2-oxoethyl] 1-methyl-2-oxopyridine-4-carboxylate
CID 55994298

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide?
The IUPAC name of N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide (CID 810478) is N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide is CCNc1nc(-c2cccc(NC(=O)COC)c2)cs1.
What is the InChIKey of N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide?
The InChIKey is HNRCXGDBKKMBSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-3-15-14-17-12(9-20-14)10-5-4-6-11(7-10)16-13(18)8-19-2/h4-7,9H,3,8H2,1-2H3,(H,15,17)(H,16,18).
What are the key properties of N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide?
N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide has a molecular weight of 291.38 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(ethylamino)-1,3-thiazol-4-yl]phenyl]-2-methoxyacetamide is sourced from PubChem (CID 810478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).