N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide

C18H21N3O2S — CID 131947902

IUPACN-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide
SMILESCc1nc(C)c(CC(=O)Nc2ccc(CC(=O)NC3CC3)cc2)s1
InChIInChI=1S/C18H21N3O2S/c1-11-16(24-12(2)19-11)10-18(23)21-14-5-3-13(4-6-14)9-17(22)20-15-7-8-15/h3-6,15H,7-10H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyNYUKTWDOTUFYEF-UHFFFAOYSA-N
MW343.45 g/mol
LogP2.76
Rot. Bonds6

About N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide

N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide (PubChem CID 131947902) has the molecular formula C18H21N3O2S and a molecular weight of 343.45 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide
PubChem CID131947902
Molecular FormulaC18H21N3O2S
Molecular Weight343.45 g/mol
Exact Mass343.14
IUPAC NameN-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide
SMILESCc1nc(C)c(CC(=O)Nc2ccc(CC(=O)NC3CC3)cc2)s1
InChIInChI=1S/C18H21N3O2S/c1-11-16(24-12(2)19-11)10-18(23)21-14-5-3-13(4-6-14)9-17(22)20-15-7-8-15/h3-6,15H,7-10H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyNYUKTWDOTUFYEF-UHFFFAOYSA-N
XLogP2.76
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[4-(diethylamino)phenyl]-2-(2,4-dimethyl-1,3-thiazol-5-yl)acetamide
CID 110328812
2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(4-piperidin-1-ylphenyl)acetamide
CID 110328814
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,4-dimethyl-1,3-thiazol-5-yl)acetamide
CID 45492808
N-cyclopropyl-2-[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]acetamide
CID 64542073
N-cyclopropyl-2-[4-[[2-(3-methyl-1,2-oxazol-5-yl)acetyl]amino]phenyl]acetamide
CID 131897959
N-cyclopropyl-2-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]acetamide
CID 131905029
N-cyclopropyl-2-[2-(methoxymethyl)-4-methyl-1,3-thiazol-5-yl]acetamide
CID 110374533
N-[(3R)-1-(4-chlorophenyl)-5-oxopyrrolidin-3-yl]-2-(2,4-dimethyl-1,3-thiazol-5-yl)acetamide
CID 125159195
N-cyclopropyl-2-(4-methyl-2-pyridin-2-yl-1,3-thiazol-5-yl)acetamide
CID 110328901
2-(2,4-dimethyl-1,3-thiazol-5-yl)-N-[4-methoxy-3-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 131896511
N-[4-(cyclopropylamino)phenyl]-2-(4-methoxyphenyl)acetamide
CID 112979974
N-cyclopropyl-2-[[N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-N'-methylcarbamimidoyl]amino]acetamide
CID 119163267

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide (CID 131947902) is N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide is Cc1nc(C)c(CC(=O)Nc2ccc(CC(=O)NC3CC3)cc2)s1.
What is the InChIKey of N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide?
The InChIKey is NYUKTWDOTUFYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2S/c1-11-16(24-12(2)19-11)10-18(23)21-14-5-3-13(4-6-14)9-17(22)20-15-7-8-15/h3-6,15H,7-10H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide?
N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide has a molecular weight of 343.45 g/mol, XLogP of 2.76, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-[[2-(2,4-dimethyl-1,3-thiazol-5-yl)acetyl]amino]phenyl]acetamide is sourced from PubChem (CID 131947902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).