7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide

C16H18N2O4 — CID 51684426

IUPAC7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide
SMILESCOc1ccc2c(=O)c(C(=O)NC[C@H]3CCCO3)c[nH]c2c1
InChIInChI=1S/C16H18N2O4/c1-21-10-4-5-12-14(7-10)17-9-13(15(12)19)16(20)18-8-11-3-2-6-22-11/h4-5,7,9,11H,2-3,6,8H2,1H3,(H,17,19)(H,18,20)/t11-/m1/s1
InChIKeyVTLMHPMABVCJKH-LLVKDONJSA-N
MW302.33 g/mol
LogP1.45
Rot. Bonds4

About 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide

7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide (PubChem CID 51684426) has the molecular formula C16H18N2O4 and a molecular weight of 302.33 g/mol. Its IUPAC name is 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide
PubChem CID51684426
Molecular FormulaC16H18N2O4
Molecular Weight302.33 g/mol
Exact Mass302.13
IUPAC Name7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide
SMILESCOc1ccc2c(=O)c(C(=O)NC[C@H]3CCCO3)c[nH]c2c1
InChIInChI=1S/C16H18N2O4/c1-21-10-4-5-12-14(7-10)17-9-13(15(12)19)16(20)18-8-11-3-2-6-22-11/h4-5,7,9,11H,2-3,6,8H2,1H3,(H,17,19)(H,18,20)/t11-/m1/s1
InChIKeyVTLMHPMABVCJKH-LLVKDONJSA-N
XLogP1.45
TPSA80.42 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide with MolForge

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Related Compounds

8-methoxy-4-oxo-N-(oxolan-2-ylmethyl)-1H-quinoline-3-carboxamide
CID 43831833
8-ethyl-4-oxo-N-[[(2S)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide
CID 25322575
3-methoxy-N-[[(2S)-oxolan-2-yl]methyl]benzamide
CID 669434
6-methoxy-N-(oxolan-2-ylmethyl)-3-phenylsulfanyl-1H-indole-2-carboxamide
CID 22513815
2-[3-(7-methoxy-4-methyl-2-oxochromen-3-yl)propanoylamino]-N-(oxolan-2-ylmethyl)benzamide
CID 42924141
3,5-dichloro-2-[(4-methoxybenzoyl)amino]-N-(oxolan-2-ylmethyl)benzamide
CID 2941545
2-(2,4-dimethoxyphenyl)-N-(oxolan-2-ylmethyl)acetamide
CID 46418634
2-[(2,5-dimethoxyphenyl)sulfonylamino]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 8843784
4-N-[(4-methoxyphenyl)methyl]-1-N-(oxolan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109045580
2,3-dimethoxy-N-(oxolan-2-ylmethyl)benzamide
CID 4781408
3-(oxolan-2-ylmethylcarbamoyl)-1H-indole-4-carboxylic acid
CID 167919642
methyl 3-[[(2R)-oxolan-2-yl]methyl-[2-[(4-oxo-1H-quinoline-3-carbonyl)amino]acetyl]amino]propanoate
CID 96503451

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide?
The IUPAC name of 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide (CID 51684426) is 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide.
What is the SMILES notation for 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide?
The canonical SMILES for 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide is COc1ccc2c(=O)c(C(=O)NC[C@H]3CCCO3)c[nH]c2c1.
What is the InChIKey of 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide?
The InChIKey is VTLMHPMABVCJKH-LLVKDONJSA-N. The full InChI is InChI=1S/C16H18N2O4/c1-21-10-4-5-12-14(7-10)17-9-13(15(12)19)16(20)18-8-11-3-2-6-22-11/h4-5,7,9,11H,2-3,6,8H2,1H3,(H,17,19)(H,18,20)/t11-/m1/s1.
What are the key properties of 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide?
7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide has a molecular weight of 302.33 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-4-oxo-N-[[(2R)-oxolan-2-yl]methyl]-1H-quinoline-3-carboxamide is sourced from PubChem (CID 51684426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).