N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide

C16H16N4O — CID 110704495

IUPACN-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2cccn3ccnc23)cc1
InChIInChI=1S/C16H16N4O/c1-19(2)13-7-5-12(6-8-13)18-16(21)14-4-3-10-20-11-9-17-15(14)20/h3-11H,1-2H3,(H,18,21)
InChIKeyDPRLXHUHJUYFIX-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.65
Rot. Bonds3

About N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide

N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide (PubChem CID 110704495) has the molecular formula C16H16N4O and a molecular weight of 280.33 g/mol. Its IUPAC name is N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide
PubChem CID110704495
Molecular FormulaC16H16N4O
Molecular Weight280.33 g/mol
Exact Mass280.13
IUPAC NameN-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide
SMILESCN(C)c1ccc(NC(=O)c2cccn3ccnc23)cc1
InChIInChI=1S/C16H16N4O/c1-19(2)13-7-5-12(6-8-13)18-16(21)14-4-3-10-20-11-9-17-15(14)20/h3-11H,1-2H3,(H,18,21)
InChIKeyDPRLXHUHJUYFIX-UHFFFAOYSA-N
XLogP2.65
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide?
The IUPAC name of N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide (CID 110704495) is N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide.
What is the SMILES notation for N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide?
The canonical SMILES for N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide is CN(C)c1ccc(NC(=O)c2cccn3ccnc23)cc1.
What is the InChIKey of N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide?
The InChIKey is DPRLXHUHJUYFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O/c1-19(2)13-7-5-12(6-8-13)18-16(21)14-4-3-10-20-11-9-17-15(14)20/h3-11H,1-2H3,(H,18,21).
What are the key properties of N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide?
N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dimethylamino)phenyl]imidazo[1,2-a]pyridine-8-carboxamide is sourced from PubChem (CID 110704495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).