N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide

C15H17N3O2 — CID 107261783

IUPACN-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide
SMILESCc1cc(N(C)C)ccc1NC(=O)c1cccc(=O)[nH]1
InChIInChI=1S/C15H17N3O2/c1-10-9-11(18(2)3)7-8-12(10)17-15(20)13-5-4-6-14(19)16-13/h4-9H,1-3H3,(H,16,19)(H,17,20)
InChIKeyDJNZHMVIFBOFQT-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.00
Rot. Bonds3

About N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide

N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 107261783) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide
PubChem CID107261783
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC NameN-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide
SMILESCc1cc(N(C)C)ccc1NC(=O)c1cccc(=O)[nH]1
InChIInChI=1S/C15H17N3O2/c1-10-9-11(18(2)3)7-8-12(10)17-15(20)13-5-4-6-14(19)16-13/h4-9H,1-3H3,(H,16,19)(H,17,20)
InChIKeyDJNZHMVIFBOFQT-UHFFFAOYSA-N
XLogP2.00
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(2-methylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107261390
4-amino-N-[4-(dimethylamino)-2-methylphenyl]benzamide
CID 43700590
N-(3,4-dimethylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107261392
N-[4-(dimethylamino)-2-methylphenyl]-5-iodothiophene-3-carboxamide
CID 78948667
3-bromo-N-[4-(dimethylamino)-2-methylphenyl]-2-fluorobenzamide
CID 106544263
3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide
CID 2081678
N-[4-(dimethylamino)-2-methylphenyl]-2-methyl-2-(methylamino)propanamide
CID 55122413
N-(2-amino-4-bromophenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 114040041
3-bromo-N-[4-(dimethylamino)-2-methylphenyl]pyridine-2-carboxamide
CID 107518241
2-chloro-N-[4-(dimethylamino)-2-methylphenyl]propanamide
CID 43696996
N-(2-methoxyphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107261599
N-(5-carbamoyl-3-fluoro-2-methylphenyl)-6-oxo-1H-pyridine-2-carboxamide
CID 107362899

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide (CID 107261783) is N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide is Cc1cc(N(C)C)ccc1NC(=O)c1cccc(=O)[nH]1.
What is the InChIKey of N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is DJNZHMVIFBOFQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-9-11(18(2)3)7-8-12(10)17-15(20)13-5-4-6-14(19)16-13/h4-9H,1-3H3,(H,16,19)(H,17,20).
What are the key properties of N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide?
N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.00, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)-2-methylphenyl]-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 107261783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).