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

C15H19N3OS — CID 86784441

IUPAC2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide
SMILESCc1cnc(CCN(C)C(=O)C(N)c2ccccc2)s1
InChIInChI=1S/C15H19N3OS/c1-11-10-17-13(20-11)8-9-18(2)15(19)14(16)12-6-4-3-5-7-12/h3-7,10,14H,8-9,16H2,1-2H3
InChIKeyQWCDNSHSYAHFRC-UHFFFAOYSA-N
MW289.40 g/mol
LogP2.15
Rot. Bonds5

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

2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide (PubChem CID 86784441) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide
PubChem CID86784441
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide
SMILESCc1cnc(CCN(C)C(=O)C(N)c2ccccc2)s1
InChIInChI=1S/C15H19N3OS/c1-11-10-17-13(20-11)8-9-18(2)15(19)14(16)12-6-4-3-5-7-12/h3-7,10,14H,8-9,16H2,1-2H3
InChIKeyQWCDNSHSYAHFRC-UHFFFAOYSA-N
XLogP2.15
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide?
The IUPAC name of 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide (CID 86784441) is 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide.
What is the SMILES notation for 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide?
The canonical SMILES for 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide is Cc1cnc(CCN(C)C(=O)C(N)c2ccccc2)s1.
What is the InChIKey of 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide?
The InChIKey is QWCDNSHSYAHFRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-11-10-17-13(20-11)8-9-18(2)15(19)14(16)12-6-4-3-5-7-12/h3-7,10,14H,8-9,16H2,1-2H3.
What are the key properties of 2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide?
2-amino-N-methyl-N-[2-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide has a molecular weight of 289.40 g/mol, XLogP of 2.15, 5 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-(5-methyl-1,3-thiazol-2-yl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 86784441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).