2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide

C22H18N2O2S — CID 121177728

IUPAC2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)NCc1cccnc1-c1ccsc1
InChIInChI=1S/C22H18N2O2S/c25-21(14-26-20-8-7-16-4-1-2-5-17(16)12-20)24-13-18-6-3-10-23-22(18)19-9-11-27-15-19/h1-12,15H,13-14H2,(H,24,25)
InChIKeyLTOYRMPCMLHOCA-UHFFFAOYSA-N
MW374.47 g/mol
LogP4.66
Rot. Bonds6

About 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide

2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide (PubChem CID 121177728) has the molecular formula C22H18N2O2S and a molecular weight of 374.47 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide
PubChem CID121177728
Molecular FormulaC22H18N2O2S
Molecular Weight374.47 g/mol
Exact Mass374.11
IUPAC Name2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide
SMILESO=C(COc1ccc2ccccc2c1)NCc1cccnc1-c1ccsc1
InChIInChI=1S/C22H18N2O2S/c25-21(14-26-20-8-7-16-4-1-2-5-17(16)12-20)24-13-18-6-3-10-23-22(18)19-9-11-27-15-19/h1-12,15H,13-14H2,(H,24,25)
InChIKeyLTOYRMPCMLHOCA-UHFFFAOYSA-N
XLogP4.66
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.47
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-propan-2-ylphenoxy)-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide
CID 121177656
N-[(2-thiophen-3-yl-3-pyridinyl)methyl]naphthalene-2-carboxamide
CID 121177783
2-indol-1-yl-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide
CID 91630228
N-[(2-thiophen-3-yl-3-pyridinyl)methyl]quinoxaline-2-carboxamide
CID 121177637
5-methyl-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]-1,2-oxazole-3-carboxamide
CID 91630166
3-(3-methylthiophen-2-yl)-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]propanamide
CID 121177697
2-bromo-5-methoxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]benzamide
CID 91630201
N-[(2-chlorophenyl)methyl]-2-quinolin-6-yloxyacetamide
CID 112978604
N-[(2-fluorophenyl)methyl]-2-quinolin-6-yloxyacetamide
CID 112978602
4-bromo-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]thiophene-2-carboxamide
CID 121177843
2-pyridin-3-yloxy-N-[(5-thiophen-3-yl-3-pyridinyl)methyl]acetamide
CID 90627965
N-[(2-thiophen-3-yl-3-pyridinyl)methyl]-1H-indole-6-carboxamide
CID 121177736

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide?
The IUPAC name of 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide (CID 121177728) is 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide is O=C(COc1ccc2ccccc2c1)NCc1cccnc1-c1ccsc1.
What is the InChIKey of 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide?
The InChIKey is LTOYRMPCMLHOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2S/c25-21(14-26-20-8-7-16-4-1-2-5-17(16)12-20)24-13-18-6-3-10-23-22(18)19-9-11-27-15-19/h1-12,15H,13-14H2,(H,24,25).
What are the key properties of 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide?
2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide has a molecular weight of 374.47 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-N-[(2-thiophen-3-yl-3-pyridinyl)methyl]acetamide is sourced from PubChem (CID 121177728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).