2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide

C19H18N2O3 — CID 67173684

IUPAC2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide
SMILESCOc1ccc(CN(C(=O)CO)c2ccc3cccnc3c2)cc1
InChIInChI=1S/C19H18N2O3/c1-24-17-8-4-14(5-9-17)12-21(19(23)13-22)16-7-6-15-3-2-10-20-18(15)11-16/h2-11,22H,12-13H2,1H3
InChIKeyCYOIKGJYNQEYMY-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.77
Rot. Bonds5

About 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide

2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide (PubChem CID 67173684) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide.

Molecular Properties

Compound Name2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide
PubChem CID67173684
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide
SMILESCOc1ccc(CN(C(=O)CO)c2ccc3cccnc3c2)cc1
InChIInChI=1S/C19H18N2O3/c1-24-17-8-4-14(5-9-17)12-21(19(23)13-22)16-7-6-15-3-2-10-20-18(15)11-16/h2-11,22H,12-13H2,1H3
InChIKeyCYOIKGJYNQEYMY-UHFFFAOYSA-N
XLogP2.77
TPSA62.66 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide?
The IUPAC name of 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide (CID 67173684) is 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide.
What is the SMILES notation for 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide?
The canonical SMILES for 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide is COc1ccc(CN(C(=O)CO)c2ccc3cccnc3c2)cc1.
What is the InChIKey of 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide?
The InChIKey is CYOIKGJYNQEYMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-24-17-8-4-14(5-9-17)12-21(19(23)13-22)16-7-6-15-3-2-10-20-18(15)11-16/h2-11,22H,12-13H2,1H3.
What are the key properties of 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide?
2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide has a molecular weight of 322.36 g/mol, XLogP of 2.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-[(4-methoxyphenyl)methyl]-N-quinolin-7-ylacetamide is sourced from PubChem (CID 67173684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).