3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide

C19H25N3O2S — CID 46525016

IUPAC3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
SMILESCCc1ccc(CCC(=O)Nc2nc(CN3CCOCC3)cs2)cc1
InChIInChI=1S/C19H25N3O2S/c1-2-15-3-5-16(6-4-15)7-8-18(23)21-19-20-17(14-25-19)13-22-9-11-24-12-10-22/h3-6,14H,2,7-13H2,1H3,(H,20,21,23)
InChIKeyPMKJKQZJBHFSGV-UHFFFAOYSA-N
MW359.50 g/mol
LogP3.11
Rot. Bonds7

About 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide

3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide (PubChem CID 46525016) has the molecular formula C19H25N3O2S and a molecular weight of 359.50 g/mol. Its IUPAC name is 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide.

Molecular Properties

Compound Name3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
PubChem CID46525016
Molecular FormulaC19H25N3O2S
Molecular Weight359.50 g/mol
Exact Mass359.17
IUPAC Name3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
SMILESCCc1ccc(CCC(=O)Nc2nc(CN3CCOCC3)cs2)cc1
InChIInChI=1S/C19H25N3O2S/c1-2-15-3-5-16(6-4-15)7-8-18(23)21-19-20-17(14-25-19)13-22-9-11-24-12-10-22/h3-6,14H,2,7-13H2,1H3,(H,20,21,23)
InChIKeyPMKJKQZJBHFSGV-UHFFFAOYSA-N
XLogP3.11
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.50
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-3-naphthalen-2-ylpropanamide
CID 55855793
N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylpropanamide
CID 30547818
4-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]pentanamide
CID 47106209
2-(4-hydroxyphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]acetamide
CID 78837285
N-[4-(2-amino-2-oxoethyl)-1,3-thiazol-2-yl]-3-(4-ethylphenyl)propanamide
CID 17443412
1-methyl-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea
CID 47173590
N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide
CID 55415179
2-amino-2-methyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
CID 119830508
4-bromo-N-[3-[[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]amino]-3-oxopropyl]benzamide
CID 31005479
3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide
CID 29324939
N-(4-ethylphenyl)-2-[2-(morpholin-4-ylmethyl)-1,3-thiazol-4-yl]acetamide
CID 110387017
2-(4-chlorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]acetamide
CID 78776000

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide?
The IUPAC name of 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide (CID 46525016) is 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide.
What is the SMILES notation for 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide?
The canonical SMILES for 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide is CCc1ccc(CCC(=O)Nc2nc(CN3CCOCC3)cs2)cc1.
What is the InChIKey of 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide?
The InChIKey is PMKJKQZJBHFSGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2S/c1-2-15-3-5-16(6-4-15)7-8-18(23)21-19-20-17(14-25-19)13-22-9-11-24-12-10-22/h3-6,14H,2,7-13H2,1H3,(H,20,21,23).
What are the key properties of 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide?
3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide has a molecular weight of 359.50 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]propanamide is sourced from PubChem (CID 46525016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).