4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide

C19H18N4O2 — CID 119052210

IUPAC4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide
SMILESCc1cc(C(=O)NCC(=O)Nc2cccnc2)c2nccc(C)c2c1
InChIInChI=1S/C19H18N4O2/c1-12-8-15-13(2)5-7-21-18(15)16(9-12)19(25)22-11-17(24)23-14-4-3-6-20-10-14/h3-10H,11H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyVMMOEHKCBRBIOY-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.62
Rot. Bonds4

About 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide

4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide (PubChem CID 119052210) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide.

Molecular Properties

Compound Name4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide
PubChem CID119052210
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC Name4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide
SMILESCc1cc(C(=O)NCC(=O)Nc2cccnc2)c2nccc(C)c2c1
InChIInChI=1S/C19H18N4O2/c1-12-8-15-13(2)5-7-21-18(15)16(9-12)19(25)22-11-17(24)23-14-4-3-6-20-10-14/h3-10H,11H2,1-2H3,(H,22,25)(H,23,24)
InChIKeyVMMOEHKCBRBIOY-UHFFFAOYSA-N
XLogP2.62
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]benzamide
CID 26592239
N-[2-(4-methylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705464
N-[2-(3-acetylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705505
N-[2-oxo-2-(pyridin-3-ylamino)ethyl]-4-phenoxybenzamide
CID 4788207
2-(4-methylphenyl)-N-pyridin-3-ylacetamide
CID 890802
3-nitro-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]benzamide
CID 26591854
2-[[N'-methyl-N-(pyridin-2-ylmethyl)carbamimidoyl]amino]-N-pyridin-3-ylacetamide
CID 110969344
2-[(N-benzyl-N'-methylcarbamimidoyl)amino]-N-pyridin-3-ylacetamide
CID 110953442
2-[[N-ethyl-N'-[(3-methylphenyl)methyl]carbamimidoyl]amino]-N-pyridin-3-ylacetamide;hydroiodide
CID 111901378
N-[2-(3-bromoanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705521
N-[2-(2,4-dimethylanilino)-2-oxoethyl]pyridine-3-carboxamide
CID 110705466
2-(2,4-dichloro-6-methylphenoxy)-N-pyridin-3-ylacetamide
CID 738217

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide?
The IUPAC name of 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide (CID 119052210) is 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide.
What is the SMILES notation for 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide?
The canonical SMILES for 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide is Cc1cc(C(=O)NCC(=O)Nc2cccnc2)c2nccc(C)c2c1.
What is the InChIKey of 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide?
The InChIKey is VMMOEHKCBRBIOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-12-8-15-13(2)5-7-21-18(15)16(9-12)19(25)22-11-17(24)23-14-4-3-6-20-10-14/h3-10H,11H2,1-2H3,(H,22,25)(H,23,24).
What are the key properties of 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide?
4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 2.62, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-N-[2-oxo-2-(pyridin-3-ylamino)ethyl]quinoline-8-carboxamide is sourced from PubChem (CID 119052210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).