N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide

C14H16N2OS — CID 66290268

IUPACN-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1CNCc1cccs1
InChIInChI=1S/C14H16N2OS/c1-11(17)16-14-7-3-2-5-12(14)9-15-10-13-6-4-8-18-13/h2-8,15H,9-10H2,1H3,(H,16,17)
InChIKeyCQNVPOPBKFUXBH-UHFFFAOYSA-N
MW260.36 g/mol
LogP3.00
Rot. Bonds5

About N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide

N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide (PubChem CID 66290268) has the molecular formula C14H16N2OS and a molecular weight of 260.36 g/mol. Its IUPAC name is N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide
PubChem CID66290268
Molecular FormulaC14H16N2OS
Molecular Weight260.36 g/mol
Exact Mass260.10
IUPAC NameN-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1CNCc1cccs1
InChIInChI=1S/C14H16N2OS/c1-11(17)16-14-7-3-2-5-12(14)9-15-10-13-6-4-8-18-13/h2-8,15H,9-10H2,1H3,(H,16,17)
InChIKeyCQNVPOPBKFUXBH-UHFFFAOYSA-N
XLogP3.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 115732622
N-(2-acetamidophenyl)-2-thiophen-2-ylacetamide
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1-[2-(methylsulfinylmethyl)phenyl]-3-(thiophen-2-ylmethyl)urea
CID 75507329
N-[2-[(4,4,4-trifluorobutylamino)methyl]phenyl]acetamide
CID 115474667
(3R)-N-(2-ethylphenyl)-3-(thiophen-2-ylmethylamino)butanamide
CID 97059465
N-[2-[(2-thiophen-3-ylethylamino)methyl]phenyl]acetamide
CID 66417096
N-[2-[(tert-butylamino)methyl]phenyl]acetamide
CID 66385215
1-naphthalen-1-yl-N-(thiophen-2-ylmethyl)methanamine;hydrochloride
CID 17289837
2-(2-acetamidophenyl)ethanethioic S-acid
CID 21276599
N-[2-[[3-(dimethylamino)propylamino]methyl]phenyl]acetamide
CID 66385636
N-tert-butyl-2-[(thiophen-2-ylmethylamino)methyl]benzenesulfonamide
CID 48563028
N-(2,6-diethylphenyl)-2-(thiophen-2-ylmethylamino)acetamide
CID 2455483

Frequently Asked Questions

What is the IUPAC name of N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide?
The IUPAC name of N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide (CID 66290268) is N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide.
What is the SMILES notation for N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide?
The canonical SMILES for N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide is CC(=O)Nc1ccccc1CNCc1cccs1.
What is the InChIKey of N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide?
The InChIKey is CQNVPOPBKFUXBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2OS/c1-11(17)16-14-7-3-2-5-12(14)9-15-10-13-6-4-8-18-13/h2-8,15H,9-10H2,1H3,(H,16,17).
What are the key properties of N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide?
N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide has a molecular weight of 260.36 g/mol, XLogP of 3.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(thiophen-2-ylmethylamino)methyl]phenyl]acetamide is sourced from PubChem (CID 66290268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).