5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide

C17H23N3O2S2 — CID 29324093

IUPAC5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide
SMILESCCCc1cc(C(=O)Nc2nc(CN3CCOCC3)cs2)sc1C
InChIInChI=1S/C17H23N3O2S2/c1-3-4-13-9-15(24-12(13)2)16(21)19-17-18-14(11-23-17)10-20-5-7-22-8-6-20/h9,11H,3-8,10H2,1-2H3,(H,18,19,21)
InChIKeyNXJVCDOEVPUNIS-UHFFFAOYSA-N
MW365.52 g/mol
LogP3.55
Rot. Bonds6

About 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide

5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide (PubChem CID 29324093) has the molecular formula C17H23N3O2S2 and a molecular weight of 365.52 g/mol. Its IUPAC name is 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide
PubChem CID29324093
Molecular FormulaC17H23N3O2S2
Molecular Weight365.52 g/mol
Exact Mass365.12
IUPAC Name5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide
SMILESCCCc1cc(C(=O)Nc2nc(CN3CCOCC3)cs2)sc1C
InChIInChI=1S/C17H23N3O2S2/c1-3-4-13-9-15(24-12(13)2)16(21)19-17-18-14(11-23-17)10-20-5-7-22-8-6-20/h9,11H,3-8,10H2,1-2H3,(H,18,19,21)
InChIKeyNXJVCDOEVPUNIS-UHFFFAOYSA-N
XLogP3.55
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.52
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,5-dimethyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]thiophene-3-carboxamide
CID 29324595
N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-5-propyl-1H-pyrazole-3-carboxamide
CID 86834146
4,5-dimethyl-N-[4-[(4-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 30185625
1-methyl-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea
CID 47173590
2-hydroxy-5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]benzamide
CID 46525048
6-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]pyridine-3-carboxamide
CID 29324984
2-amino-2-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
CID 119830508
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-5-methyl-4-propylthiophene-2-carboxamide
CID 26893935
3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
CID 46525016
2-ethoxy-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]benzamide
CID 30547705
(2S)-2-amino-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide;dihydrochloride
CID 119830551
4-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]pentanamide
CID 47106209

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide?
The IUPAC name of 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide (CID 29324093) is 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide.
What is the SMILES notation for 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide?
The canonical SMILES for 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide is CCCc1cc(C(=O)Nc2nc(CN3CCOCC3)cs2)sc1C.
What is the InChIKey of 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide?
The InChIKey is NXJVCDOEVPUNIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2S2/c1-3-4-13-9-15(24-12(13)2)16(21)19-17-18-14(11-23-17)10-20-5-7-22-8-6-20/h9,11H,3-8,10H2,1-2H3,(H,18,19,21).
What are the key properties of 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide?
5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide has a molecular weight of 365.52 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-4-propylthiophene-2-carboxamide is sourced from PubChem (CID 29324093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).