N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide

About N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide

N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 109074186) has the molecular formula C21H27N5O2 and a molecular weight of 381.48 g/mol. Its IUPAC name is N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name	N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
PubChem CID	109074186
Molecular Formula	C21H27N5O2
Molecular Weight	381.48 g/mol
Exact Mass	381.22
IUPAC Name	N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
SMILES	CN(C)c1ccc(NC(=O)c2nc(C(=O)N3CCCC3)c3n2CCCC3)cc1
InChI	InChI=1S/C21H27N5O2/c1-24(2)16-10-8-15(9-11-16)22-20(27)19-23-18(17-7-3-4-14-26(17)19)21(28)25-12-5-6-13-25/h8-11H,3-7,12-14H2,1-2H3,(H,22,27)
InChIKey	VGTYJIWABWJKAD-UHFFFAOYSA-N
XLogP	2.77
TPSA	70.47 Å²
H-Bond Donors	1
H-Bond Acceptors	5
Rotatable Bonds	4
Heavy Atoms	28
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	381.48
LogP ≤ 5	2.77
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Computed Properties (RDKit)

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

Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

The IUPAC name of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide (CID 109074186) is N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide.

What is the SMILES notation for N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

The canonical SMILES for N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is CN(C)c1ccc(NC(=O)c2nc(C(=O)N3CCCC3)c3n2CCCC3)cc1.

What is the InChIKey of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

The InChIKey is VGTYJIWABWJKAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N5O2/c1-24(2)16-10-8-15(9-11-16)22-20(27)19-23-18(17-7-3-4-14-26(17)19)21(28)25-12-5-6-13-25/h8-11H,3-7,12-14H2,1-2H3,(H,22,27).

What are the key properties of N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide?

N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 381.48 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(dimethylamino)phenyl]-1-(pyrrolidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 109074186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).