N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide

C17H22N2OS — CID 61334340

IUPACN-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide
SMILESCCc1ccc(C(C)Nc2ccc(NC(C)=O)c(C)c2)s1
InChIInChI=1S/C17H22N2OS/c1-5-15-7-9-17(21-15)12(3)18-14-6-8-16(11(2)10-14)19-13(4)20/h6-10,12,18H,5H2,1-4H3,(H,19,20)
InChIKeyCXYDGGFSBPAOPO-UHFFFAOYSA-N
MW302.44 g/mol
LogP4.75
Rot. Bonds5

About N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide

N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide (PubChem CID 61334340) has the molecular formula C17H22N2OS and a molecular weight of 302.44 g/mol. Its IUPAC name is N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide
PubChem CID61334340
Molecular FormulaC17H22N2OS
Molecular Weight302.44 g/mol
Exact Mass302.15
IUPAC NameN-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide
SMILESCCc1ccc(C(C)Nc2ccc(NC(C)=O)c(C)c2)s1
InChIInChI=1S/C17H22N2OS/c1-5-15-7-9-17(21-15)12(3)18-14-6-8-16(11(2)10-14)19-13(4)20/h6-10,12,18H,5H2,1-4H3,(H,19,20)
InChIKeyCXYDGGFSBPAOPO-UHFFFAOYSA-N
XLogP4.75
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]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-[3-[1-(5-ethylthiophen-2-yl)ethylamino]phenyl]acetamide
CID 61335117
3-chloro-N-[1-(5-ethylthiophen-2-yl)ethyl]-4-methylaniline
CID 55186067
N-[4-(butan-2-ylamino)-2-methylphenyl]acetamide
CID 43672867
N-[2-methyl-4-(pentan-3-ylamino)phenyl]acetamide
CID 43672883
4-[1-(5-ethylthiophen-2-yl)ethylamino]benzoic acid
CID 61333563
1-N-[1-(5-ethylthiophen-2-yl)ethyl]-3-N,3-N,4-trimethylbenzene-1,3-diamine
CID 115376974
2-[4-[1-(5-ethylthiophen-2-yl)ethylamino]phenyl]acetamide
CID 61334963
4-[1-(5-ethylthiophen-2-yl)ethylamino]-N,N-dimethylbenzamide
CID 61335120
N-[2-methyl-4-[[(1R)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 34284461
N-[2-methyl-4-[[(1S)-1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]amino]phenyl]acetamide
CID 34284466
N-[1-(5-ethylthiophen-2-yl)ethyl]-3,4-dimethoxyaniline
CID 61334130
N-[2-methyl-4-(1-pyridin-4-ylethylamino)phenyl]acetamide
CID 43672879

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide?
The IUPAC name of N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide (CID 61334340) is N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide.
What is the SMILES notation for N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide?
The canonical SMILES for N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide is CCc1ccc(C(C)Nc2ccc(NC(C)=O)c(C)c2)s1.
What is the InChIKey of N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide?
The InChIKey is CXYDGGFSBPAOPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2OS/c1-5-15-7-9-17(21-15)12(3)18-14-6-8-16(11(2)10-14)19-13(4)20/h6-10,12,18H,5H2,1-4H3,(H,19,20).
What are the key properties of N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide?
N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide has a molecular weight of 302.44 g/mol, XLogP of 4.75, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(5-ethylthiophen-2-yl)ethylamino]-2-methylphenyl]acetamide is sourced from PubChem (CID 61334340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).