2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide

C15H19N3OS — CID 62489621

IUPAC2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide
SMILESCc1ncc(CN(C)C(=O)C(C)(N)c2ccccc2)s1
InChIInChI=1S/C15H19N3OS/c1-11-17-9-13(20-11)10-18(3)14(19)15(2,16)12-7-5-4-6-8-12/h4-9H,10,16H2,1-3H3
InChIKeyLGNBSWIESBGLFM-UHFFFAOYSA-N
MW289.40 g/mol
LogP2.28
Rot. Bonds4

About 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide

2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide (PubChem CID 62489621) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide
PubChem CID62489621
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide
SMILESCc1ncc(CN(C)C(=O)C(C)(N)c2ccccc2)s1
InChIInChI=1S/C15H19N3OS/c1-11-17-9-13(20-11)10-18(3)14(19)15(2,16)12-7-5-4-6-8-12/h4-9H,10,16H2,1-3H3
InChIKeyLGNBSWIESBGLFM-UHFFFAOYSA-N
XLogP2.28
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide 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-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide?
The IUPAC name of 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide (CID 62489621) is 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide?
The canonical SMILES for 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide is Cc1ncc(CN(C)C(=O)C(C)(N)c2ccccc2)s1.
What is the InChIKey of 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide?
The InChIKey is LGNBSWIESBGLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-11-17-9-13(20-11)10-18(3)14(19)15(2,16)12-7-5-4-6-8-12/h4-9H,10,16H2,1-3H3.
What are the key properties of 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide?
2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide has a molecular weight of 289.40 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-2-phenylpropanamide is sourced from PubChem (CID 62489621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).