6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide

C17H20N4O — CID 84573387

IUPAC6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2cccc(NC3CC3)n2)cc1
InChIInChI=1S/C17H20N4O/c1-21(2)14-10-8-13(9-11-14)19-17(22)15-4-3-5-16(20-15)18-12-6-7-12/h3-5,8-12H,6-7H2,1-2H3,(H,18,20)(H,19,22)
InChIKeyQVSFBPVNVYYICQ-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.97
Rot. Bonds5

About 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide

6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide (PubChem CID 84573387) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
PubChem CID84573387
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2cccc(NC3CC3)n2)cc1
InChIInChI=1S/C17H20N4O/c1-21(2)14-10-8-13(9-11-14)19-17(22)15-4-3-5-16(20-15)18-12-6-7-12/h3-5,8-12H,6-7H2,1-2H3,(H,18,20)(H,19,22)
InChIKeyQVSFBPVNVYYICQ-UHFFFAOYSA-N
XLogP2.97
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-N-cyclopropyl-2-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109093956
5-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyrazine-2-carboxamide
CID 109271899
6-(cyclopropylamino)-N-naphthalen-2-ylpyridine-2-carboxamide
CID 84573389
6-bromo-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 113343282
6-amino-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 62239989
6-(cyclohexylamino)-N-[4-(dimethylamino)phenyl]pyrimidine-4-carboxamide
CID 109341935
2-N-[4-(dimethylamino)phenyl]-6-N,6-N-dipropylpyridine-2,6-dicarboxamide
CID 109099834
6-(cycloheptylamino)-N-[4-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 109161046
2-N-[2-(dimethylamino)ethyl]-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109096394
6-(cyclopropylamino)-N-[4-(diethylamino)phenyl]pyridazine-3-carboxamide
CID 109109943
2-N,6-N-bis[4-(diethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 1019302
6-(cyclopropylamino)-N-[3-(dimethylamino)phenyl]pyridine-3-carboxamide
CID 84570944

Frequently Asked Questions

What is the IUPAC name of 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide?
The IUPAC name of 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide (CID 84573387) is 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide?
The canonical SMILES for 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide is CN(C)c1ccc(NC(=O)c2cccc(NC3CC3)n2)cc1.
What is the InChIKey of 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide?
The InChIKey is QVSFBPVNVYYICQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-21(2)14-10-8-13(9-11-14)19-17(22)15-4-3-5-16(20-15)18-12-6-7-12/h3-5,8-12H,6-7H2,1-2H3,(H,18,20)(H,19,22).
What are the key properties of 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide?
6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.97, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 84573387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).