2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide

C15H17N3O2S — CID 130452065

IUPAC2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cs1
InChIInChI=1S/C15H17N3O2S/c1-10-17-13(9-21-10)15(19)18-12-4-2-11(3-5-12)14-8-16-6-7-20-14/h2-5,9,14,16H,6-8H2,1H3,(H,18,19)/t14-/m1/s1
InChIKeyJEQFKXKYXLHVQE-CQSZACIVSA-N
MW303.39 g/mol
LogP2.36
Rot. Bonds3

About 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide

2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide (PubChem CID 130452065) has the molecular formula C15H17N3O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide
PubChem CID130452065
Molecular FormulaC15H17N3O2S
Molecular Weight303.39 g/mol
Exact Mass303.10
IUPAC Name2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide
SMILESCc1nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cs1
InChIInChI=1S/C15H17N3O2S/c1-10-17-13(9-21-10)15(19)18-12-4-2-11(3-5-12)14-8-16-6-7-20-14/h2-5,9,14,16H,6-8H2,1H3,(H,18,19)/t14-/m1/s1
InChIKeyJEQFKXKYXLHVQE-CQSZACIVSA-N
XLogP2.36
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide?
The IUPAC name of 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide (CID 130452065) is 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide?
The canonical SMILES for 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide is Cc1nc(C(=O)Nc2ccc([C@H]3CNCCO3)cc2)cs1.
What is the InChIKey of 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide?
The InChIKey is JEQFKXKYXLHVQE-CQSZACIVSA-N. The full InChI is InChI=1S/C15H17N3O2S/c1-10-17-13(9-21-10)15(19)18-12-4-2-11(3-5-12)14-8-16-6-7-20-14/h2-5,9,14,16H,6-8H2,1H3,(H,18,19)/t14-/m1/s1.
What are the key properties of 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide?
2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide has a molecular weight of 303.39 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 130452065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).