N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide

C16H20N2O2S — CID 66387774

IUPACN-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide
SMILESCOCc1ccccc1CNCc1sccc1NC(C)=O
InChIInChI=1S/C16H20N2O2S/c1-12(19)18-15-7-8-21-16(15)10-17-9-13-5-3-4-6-14(13)11-20-2/h3-8,17H,9-11H2,1-2H3,(H,18,19)
InChIKeyRDGUWSOXWXXXJO-UHFFFAOYSA-N
MW304.42 g/mol
LogP3.14
Rot. Bonds7

About N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide

N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide (PubChem CID 66387774) has the molecular formula C16H20N2O2S and a molecular weight of 304.42 g/mol. Its IUPAC name is N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide.

Molecular Properties

Compound NameN-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide
PubChem CID66387774
Molecular FormulaC16H20N2O2S
Molecular Weight304.42 g/mol
Exact Mass304.12
IUPAC NameN-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide
SMILESCOCc1ccccc1CNCc1sccc1NC(C)=O
InChIInChI=1S/C16H20N2O2S/c1-12(19)18-15-7-8-21-16(15)10-17-9-13-5-3-4-6-14(13)11-20-2/h3-8,17H,9-11H2,1-2H3,(H,18,19)
InChIKeyRDGUWSOXWXXXJO-UHFFFAOYSA-N
XLogP3.14
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophene-2-carboxylic acid
CID 103240321
N-[2-[(cyclopropylmethylamino)methyl]thiophen-3-yl]acetamide
CID 66384880
N-[2-[(3-acetamidothiophen-2-yl)methylamino]ethyl]-2-methylpropanamide
CID 66386114
N-[2-[(2-hydroxyethylamino)methyl]thiophen-3-yl]acetamide
CID 66386722
N-[2-[[(3-hydroxy-2,2-dimethylpropyl)amino]methyl]thiophen-3-yl]acetamide
CID 115359068
N-[2-[[2-(2-methylprop-2-enoxy)ethylamino]methyl]thiophen-3-yl]acetamide
CID 114465669
N-[2-[(2-ethoxyethylamino)methyl]thiophen-3-yl]acetamide
CID 66385931
N-[2-[[(6-methyl-2-pyridinyl)methylamino]methyl]thiophen-3-yl]acetamide
CID 66386200
N-[2-[[(4-propan-2-ylphenyl)methylamino]methyl]thiophen-3-yl]acetamide
CID 66386592
methyl 2-[(3-acetamidothiophen-2-yl)methylamino]-2-methylpropanoate
CID 66387556
N-[2-[(1,2-oxazol-3-ylmethylamino)methyl]thiophen-3-yl]acetamide
CID 81169972
N-[2-[[(2,5-dimethylpyrrol-1-yl)amino]methyl]thiophen-3-yl]acetamide
CID 79101536

Frequently Asked Questions

What is the IUPAC name of N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide?
The IUPAC name of N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide (CID 66387774) is N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide.
What is the SMILES notation for N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide?
The canonical SMILES for N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide is COCc1ccccc1CNCc1sccc1NC(C)=O.
What is the InChIKey of N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide?
The InChIKey is RDGUWSOXWXXXJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-12(19)18-15-7-8-21-16(15)10-17-9-13-5-3-4-6-14(13)11-20-2/h3-8,17H,9-11H2,1-2H3,(H,18,19).
What are the key properties of N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide?
N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide has a molecular weight of 304.42 g/mol, XLogP of 3.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[[2-(methoxymethyl)phenyl]methylamino]methyl]thiophen-3-yl]acetamide is sourced from PubChem (CID 66387774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).