(2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide

C19H15N3O2 — CID 97252749

IUPAC(2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide
SMILESCOc1ccccc1NC(=O)[C@@H](C#N)c1ccc2ccccc2n1
InChIInChI=1S/C19H15N3O2/c1-24-18-9-5-4-8-17(18)22-19(23)14(12-20)16-11-10-13-6-2-3-7-15(13)21-16/h2-11,14H,1H3,(H,22,23)/t14-/m0/s1
InChIKeyYSFQACKAGJSGRA-AWEZNQCLSA-N
MW317.35 g/mol
LogP3.49
Rot. Bonds4

About (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide

(2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide (PubChem CID 97252749) has the molecular formula C19H15N3O2 and a molecular weight of 317.35 g/mol. Its IUPAC name is (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide.

Molecular Properties

Compound Name(2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide
PubChem CID97252749
Molecular FormulaC19H15N3O2
Molecular Weight317.35 g/mol
Exact Mass317.12
IUPAC Name(2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide
SMILESCOc1ccccc1NC(=O)[C@@H](C#N)c1ccc2ccccc2n1
InChIInChI=1S/C19H15N3O2/c1-24-18-9-5-4-8-17(18)22-19(23)14(12-20)16-11-10-13-6-2-3-7-15(13)21-16/h2-11,14H,1H3,(H,22,23)/t14-/m0/s1
InChIKeyYSFQACKAGJSGRA-AWEZNQCLSA-N
XLogP3.49
TPSA75.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(2-cyano-2-quinolin-2-ylacetyl)-2-fluorophenyl]acetamide
CID 47073616
1-(1-cyanoethyl)-3-(2-methoxyphenyl)urea
CID 60969499
3-cyano-N-(2-methoxyphenyl)-2-methylpropanamide
CID 82114035
2-cyano-N-(2-fluorophenyl)-2-(5-fluoro-2-pyridinyl)acetamide
CID 86781330
2-cyano-N-(2-methoxyphenyl)-3-pyridin-4-ylpropanamide
CID 3169981
(2R)-2-bromo-N-(2-methoxyphenyl)propanamide
CID 737002
(2R)-2-chloro-N-(2-methoxyphenyl)propanamide
CID 2490730
N-(5-chloro-2-methoxyphenyl)quinoline-2-carboxamide
CID 2111763
N-[4,5-dimethoxy-2-(quinoline-2-carbonylamino)phenyl]quinoline-2-carboxamide
CID 91594053
2-(cyanomethylsulfanyl)-N-(2-methoxyphenyl)propanamide
CID 82180832
2-methoxy-N-(4-quinolin-2-ylphenyl)benzamide
CID 46376165
(2S)-2-cyano-N-(2-methoxyphenyl)-3-(4-methylphenyl)propanamide
CID 763342

Frequently Asked Questions

What is the IUPAC name of (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide?
The IUPAC name of (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide (CID 97252749) is (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide.
What is the SMILES notation for (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide?
The canonical SMILES for (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide is COc1ccccc1NC(=O)[C@@H](C#N)c1ccc2ccccc2n1.
What is the InChIKey of (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide?
The InChIKey is YSFQACKAGJSGRA-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H15N3O2/c1-24-18-9-5-4-8-17(18)22-19(23)14(12-20)16-11-10-13-6-2-3-7-15(13)21-16/h2-11,14H,1H3,(H,22,23)/t14-/m0/s1.
What are the key properties of (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide?
(2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide has a molecular weight of 317.35 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-cyano-N-(2-methoxyphenyl)-2-quinolin-2-ylacetamide is sourced from PubChem (CID 97252749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).