4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

C16H17N3O3 — CID 54679426

IUPAC4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCc1ccnc(NC(=O)c2c(O)c3c([nH]c2=O)CCCC3)c1
InChIInChI=1S/C16H17N3O3/c1-9-6-7-17-12(8-9)19-16(22)13-14(20)10-4-2-3-5-11(10)18-15(13)21/h6-8H,2-5H2,1H3,(H,17,19,22)(H2,18,20,21)
InChIKeyKCGNVTDZHQRFFU-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.92
Rot. Bonds2

About 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (PubChem CID 54679426) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
PubChem CID54679426
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCc1ccnc(NC(=O)c2c(O)c3c([nH]c2=O)CCCC3)c1
InChIInChI=1S/C16H17N3O3/c1-9-6-7-17-12(8-9)19-16(22)13-14(20)10-4-2-3-5-11(10)18-15(13)21/h6-8H,2-5H2,1H3,(H,17,19,22)(H2,18,20,21)
InChIKeyKCGNVTDZHQRFFU-UHFFFAOYSA-N
XLogP1.92
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide with MolForge

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Related Compounds

N-(4-methyl-2-pyridinyl)-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-carboxamide
CID 47027656
4-hydroxy-N-(4-methoxyphenyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 54706028
N-(2,4-dichlorophenyl)-4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 54706358
4-hydroxy-2-oxo-N-prop-2-enyl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
CID 54684650
methyl 4-hydroxy-2-oxo-1,5,6,7-tetrahydrocyclopenta[b]pyridine-3-carboxylate
CID 70278471
ethyl-[2-[(4-hydroxy-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carbonyl)amino]ethyl]azanium
CID 54711894
4-iodo-N-(4-methyl-2-pyridinyl)benzamide
CID 21204751
3,5-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 113349571
3-hydroxy-N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 54861359
4-amino-3-hydroxy-N-(4-methyl-2-pyridinyl)benzamide
CID 107073933
N-(4-methyl-2-pyridinyl)-6-oxo-1H-pyrimidine-4-carboxamide
CID 136666385
N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
CID 46307927

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The IUPAC name of 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CID 54679426) is 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
What is the SMILES notation for 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The canonical SMILES for 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is Cc1ccnc(NC(=O)c2c(O)c3c([nH]c2=O)CCCC3)c1.
What is the InChIKey of 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The InChIKey is KCGNVTDZHQRFFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-9-6-7-17-12(8-9)19-16(22)13-14(20)10-4-2-3-5-11(10)18-15(13)21/h6-8H,2-5H2,1H3,(H,17,19,22)(H2,18,20,21).
What are the key properties of 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 1.92, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-(4-methyl-2-pyridinyl)-2-oxo-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is sourced from PubChem (CID 54679426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).