7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide

C19H23N3O3 — CID 94815456

IUPAC7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)N[C@H](C)C(=O)N3CCCC3)c(C)nc2c1
InChIInChI=1S/C19H23N3O3/c1-12-16(10-14-6-7-15(25-3)11-17(14)20-12)18(23)21-13(2)19(24)22-8-4-5-9-22/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,21,23)/t13-/m1/s1
InChIKeyGZGHRWBWIYBNBY-CYBMUJFWSA-N
MW341.41 g/mol
LogP2.29
Rot. Bonds4

About 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide

7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide (PubChem CID 94815456) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide
PubChem CID94815456
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide
SMILESCOc1ccc2cc(C(=O)N[C@H](C)C(=O)N3CCCC3)c(C)nc2c1
InChIInChI=1S/C19H23N3O3/c1-12-16(10-14-6-7-15(25-3)11-17(14)20-12)18(23)21-13(2)19(24)22-8-4-5-9-22/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,21,23)/t13-/m1/s1
InChIKeyGZGHRWBWIYBNBY-CYBMUJFWSA-N
XLogP2.29
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide?
The IUPAC name of 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide (CID 94815456) is 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide.
What is the SMILES notation for 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide?
The canonical SMILES for 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide is COc1ccc2cc(C(=O)N[C@H](C)C(=O)N3CCCC3)c(C)nc2c1.
What is the InChIKey of 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide?
The InChIKey is GZGHRWBWIYBNBY-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-12-16(10-14-6-7-15(25-3)11-17(14)20-12)18(23)21-13(2)19(24)22-8-4-5-9-22/h6-7,10-11,13H,4-5,8-9H2,1-3H3,(H,21,23)/t13-/m1/s1.
What are the key properties of 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide?
7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-methyl-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]quinoline-3-carboxamide is sourced from PubChem (CID 94815456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).