N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide

C15H18N2O2S — CID 75498535

IUPACN-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)Nc2ccccc2C(C)O)s1
InChIInChI=1S/C15H18N2O2S/c1-3-6-14-16-9-13(20-14)15(19)17-12-8-5-4-7-11(12)10(2)18/h4-5,7-10,18H,3,6H2,1-2H3,(H,17,19)
InChIKeyCCQHZTZOPJQPSZ-UHFFFAOYSA-N
MW290.39 g/mol
LogP3.40
Rot. Bonds5

About N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide

N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide (PubChem CID 75498535) has the molecular formula C15H18N2O2S and a molecular weight of 290.39 g/mol. Its IUPAC name is N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide
PubChem CID75498535
Molecular FormulaC15H18N2O2S
Molecular Weight290.39 g/mol
Exact Mass290.11
IUPAC NameN-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1ncc(C(=O)Nc2ccccc2C(C)O)s1
InChIInChI=1S/C15H18N2O2S/c1-3-6-14-16-9-13(20-14)15(19)17-12-8-5-4-7-11(12)10(2)18/h4-5,7-10,18H,3,6H2,1-2H3,(H,17,19)
InChIKeyCCQHZTZOPJQPSZ-UHFFFAOYSA-N
XLogP3.40
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.39
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-hydroxypiperidin-1-yl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 111462834
4-fluoro-3-[(2-propyl-1,3-thiazole-5-carbonyl)amino]benzoic acid
CID 75516520
N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 43508507
(2R)-4-methyl-2-[(2-propyl-1,3-thiazole-5-carbonyl)amino]pentanoic acid
CID 119363034
N-[(2R)-2-(ethylamino)propyl]-2-propyl-1,3-thiazole-5-carboxamide
CID 120650729
2-amino-2-ethyl-N-[2-(1-hydroxyethyl)phenyl]butanamide
CID 79813414
2-hydroxy-N-[2-(1-hydroxyethyl)phenyl]benzamide
CID 43508470
3-(ethylamino)-N-[2-(1-hydroxyethyl)phenyl]-2-methylpropanamide
CID 62838572
N-(6-amino-1,3-benzodioxol-5-yl)-2-propyl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119619097
2-amino-N-(2-ethylphenyl)-1,3-thiazole-5-carboxamide
CID 141271026
N-[2-(1-hydroxyethyl)phenyl]-5-methyl-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide
CID 110904718
3-ethyl-N-[2-(1-hydroxyethyl)phenyl]-1-methylpyrazole-5-carboxamide
CID 66119763

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide (CID 75498535) is N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide is CCCc1ncc(C(=O)Nc2ccccc2C(C)O)s1.
What is the InChIKey of N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide?
The InChIKey is CCQHZTZOPJQPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S/c1-3-6-14-16-9-13(20-14)15(19)17-12-8-5-4-7-11(12)10(2)18/h4-5,7-10,18H,3,6H2,1-2H3,(H,17,19).
What are the key properties of N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide?
N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide has a molecular weight of 290.39 g/mol, XLogP of 3.40, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-hydroxyethyl)phenyl]-2-propyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 75498535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).