N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide

C16H20N2O2S — CID 63992830

IUPACN-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide
SMILESCOc1cc(NC(C)c2sccc2C)ccc1NC(C)=O
InChIInChI=1S/C16H20N2O2S/c1-10-7-8-21-16(10)11(2)17-13-5-6-14(18-12(3)19)15(9-13)20-4/h5-9,11,17H,1-4H3,(H,18,19)
InChIKeyDPFZXHZTBUUAHA-UHFFFAOYSA-N
MW304.42 g/mol
LogP4.20
Rot. Bonds5

About N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide

N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide (PubChem CID 63992830) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide
PubChem CID63992830
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC NameN-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide
SMILESCOc1cc(NC(C)c2sccc2C)ccc1NC(C)=O
InChIInChI=1S/C16H20N2O2S/c1-10-7-8-21-16(10)11(2)17-13-5-6-14(18-12(3)19)15(9-13)20-4/h5-9,11,17H,1-4H3,(H,18,19)
InChIKeyDPFZXHZTBUUAHA-UHFFFAOYSA-N
XLogP4.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]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

tert-butyl N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]carbamate
CID 113354897
N-[4-methoxy-3-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide
CID 63992462
N-[2-methoxy-4-(1-thiophen-2-ylpropylamino)phenyl]acetamide
CID 43672924
4-methoxy-3-[1-(3-methylthiophen-2-yl)ethylamino]benzoic acid
CID 63992893
N-(4-acetamido-3-methoxyphenyl)-2-methoxypropanamide
CID 47308212
4-[1-(3-methylthiophen-2-yl)ethylamino]benzamide
CID 63991012
N-[4-[[(2R)-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-oxopropan-2-yl]amino]-2-methoxyphenyl]acetamide
CID 94641757
N'-(2,4-dimethoxyphenyl)-N-[2-hydroxy-2-(3-methylthiophen-2-yl)ethyl]oxamide
CID 90496945
N-(4-formamido-2-methoxyphenyl)acetamide
CID 64990664
N-methyl-2-[4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide
CID 63991666
methyl 2-[1-(3-methylthiophen-2-yl)ethylamino]benzoate
CID 63991837
(2R)-2-(4-acetamido-3-methoxyanilino)-N-(2-methylbutan-2-yl)propanamide
CID 94641742

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide?
The IUPAC name of N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide (CID 63992830) is N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide.
What is the SMILES notation for N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide?
The canonical SMILES for N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide is COc1cc(NC(C)c2sccc2C)ccc1NC(C)=O.
What is the InChIKey of N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide?
The InChIKey is DPFZXHZTBUUAHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-10-7-8-21-16(10)11(2)17-13-5-6-14(18-12(3)19)15(9-13)20-4/h5-9,11,17H,1-4H3,(H,18,19).
What are the key properties of N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide?
N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide has a molecular weight of 304.42 g/mol, XLogP of 4.20, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-4-[1-(3-methylthiophen-2-yl)ethylamino]phenyl]acetamide is sourced from PubChem (CID 63992830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).