N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide

C19H19N3O4S — CID 2573206

IUPACN-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide
SMILESCOc1ccc(-c2nc(NC(=O)CCNC(=O)c3ccco3)sc2C)cc1
InChIInChI=1S/C19H19N3O4S/c1-12-17(13-5-7-14(25-2)8-6-13)22-19(27-12)21-16(23)9-10-20-18(24)15-4-3-11-26-15/h3-8,11H,9-10H2,1-2H3,(H,20,24)(H,21,22,23)
InChIKeyOWOBDOZVTCFGHB-UHFFFAOYSA-N
MW385.45 g/mol
LogP3.48
Rot. Bonds7

About N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide

N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide (PubChem CID 2573206) has the molecular formula C19H19N3O4S and a molecular weight of 385.45 g/mol. Its IUPAC name is N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide
PubChem CID2573206
Molecular FormulaC19H19N3O4S
Molecular Weight385.45 g/mol
Exact Mass385.11
IUPAC NameN-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide
SMILESCOc1ccc(-c2nc(NC(=O)CCNC(=O)c3ccco3)sc2C)cc1
InChIInChI=1S/C19H19N3O4S/c1-12-17(13-5-7-14(25-2)8-6-13)22-19(27-12)21-16(23)9-10-20-18(24)15-4-3-11-26-15/h3-8,11H,9-10H2,1-2H3,(H,20,24)(H,21,22,23)
InChIKeyOWOBDOZVTCFGHB-UHFFFAOYSA-N
XLogP3.48
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.45
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide with MolForge

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Related Compounds

2-(2-furoylamino)-N-mesityl-4-methyl-1,3-thiazole-5-carboxamide
CID 21911271
N-(4-phenyl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 674790
Furan-2-carboxylic acid (4-phenyl-5-pyridin-4-yl-thiazol-2-yl)-amide
CID 72197880
A1/A3 AR antagonist 2
CID 162673862
Furan-2-carboxylic acid methyl-(4-phenyl-thiazol-2-yl)-amide
CID 861583
Furan-2-carboxylic acid [4-(4-methoxy-phenyl)-thiazol-2-yl]-methyl-amide
CID 862765
N-[4-(2-amino-1,3-thiazol-4-yl)phenyl]furan-2-carboxamide
CID 8893265
N,N,4-trimethyl-2-[(3-methyl-1-benzofuran-2-carbonyl)amino]-1,3-thiazole-5-carboxamide
CID 1245933
Furan-2-carboxylic acid[5-(2-ethyl-2H-tetrazol-5-yl)-4-phenyl-thiazol-2-yl]-amide
CID 11632013
Furan-2-carboxylic acid [5-(3-methyl-[1,2,4]oxadiazol-5-yl)-4-phenyl-thiazol-2-yl]-amide
CID 11703084
N-[4-[1-(1-oxopropyl)-2,3-dihydroindol-5-yl]-2-thiazolyl]-2-furancarboxamide
CID 24761960
(4-(Furan-2-yl)-2-(methylamino)thiazol-5-yl)(phenyl)methanone
CID 44581364

Frequently Asked Questions

What is the IUPAC name of N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide?
The IUPAC name of N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide (CID 2573206) is N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide is COc1ccc(-c2nc(NC(=O)CCNC(=O)c3ccco3)sc2C)cc1.
What is the InChIKey of N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide?
The InChIKey is OWOBDOZVTCFGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4S/c1-12-17(13-5-7-14(25-2)8-6-13)22-19(27-12)21-16(23)9-10-20-18(24)15-4-3-11-26-15/h3-8,11H,9-10H2,1-2H3,(H,20,24)(H,21,22,23).
What are the key properties of N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide?
N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide has a molecular weight of 385.45 g/mol, XLogP of 3.48, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[4-(4-methoxyphenyl)-5-methyl-1,3-thiazol-2-yl]amino]-3-oxopropyl]furan-2-carboxamide is sourced from PubChem (CID 2573206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).