N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide

C19H24N4O2S — CID 86911641

About N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide

N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide (PubChem CID 86911641) has the molecular formula C19H24N4O2S and a molecular weight of 372.49 g/mol. Its IUPAC name is N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide.

Molecular Properties

• Compound Name: N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide
• PubChem CID: 86911641
• Molecular Formula: C19H24N4O2S
• Molecular Weight: 372.49 g/mol
• Exact Mass: 372.16
• IUPAC Name: N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide
• SMILES: Cc1cccc(Cc2cnc(NC(=O)CN(C)CC(=O)NC3CC3)s2)c1
• InChI: InChI=1S/C19H24N4O2S/c1-13-4-3-5-14(8-13)9-16-10-20-19(26-16)22-18(25)12-23(2)11-17(24)21-15-6-7-15/h3-5,8,10,15H,6-7,9,11-12H2,1-2H3,(H,21,24)(H,20,22,25)
• InChIKey: URYWPJOCBSUHIM-UHFFFAOYSA-N
• XLogP: 2.19
• TPSA: 74.33 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 8
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.49
LogP ≤ 5	2.19
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide?

The IUPAC name of N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide (CID 86911641) is N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide.

What is the SMILES notation for N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide?

The canonical SMILES for N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide is Cc1cccc(Cc2cnc(NC(=O)CN(C)CC(=O)NC3CC3)s2)c1.

What is the InChIKey of N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide?

The InChIKey is URYWPJOCBSUHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2S/c1-13-4-3-5-14(8-13)9-16-10-20-19(26-16)22-18(25)12-23(2)11-17(24)21-15-6-7-15/h3-5,8,10,15H,6-7,9,11-12H2,1-2H3,(H,21,24)(H,20,22,25).

What are the key properties of N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide?

N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide has a molecular weight of 372.49 g/mol, XLogP of 2.19, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-cyclopropyl-2-[methyl-[2-[[5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl]amino]-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 86911641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).