N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide

C22H32N4O2 — CID 127041480

IUPACN-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NCC2CCN(C3CCOCC3)CC2)c2ccccn12
InChIInChI=1S/C22H32N4O2/c1-16(2)21-24-20(19-5-3-4-10-26(19)21)22(27)23-15-17-6-11-25(12-7-17)18-8-13-28-14-9-18/h3-5,10,16-18H,6-9,11-15H2,1-2H3,(H,23,27)
InChIKeyZFVMTQIFMXTHFZ-UHFFFAOYSA-N
MW384.52 g/mol
LogP3.08
Rot. Bonds5

About N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide

N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 127041480) has the molecular formula C22H32N4O2 and a molecular weight of 384.52 g/mol. Its IUPAC name is N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID127041480
Molecular FormulaC22H32N4O2
Molecular Weight384.52 g/mol
Exact Mass384.25
IUPAC NameN-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NCC2CCN(C3CCOCC3)CC2)c2ccccn12
InChIInChI=1S/C22H32N4O2/c1-16(2)21-24-20(19-5-3-4-10-26(19)21)22(27)23-15-17-6-11-25(12-7-17)18-8-13-28-14-9-18/h3-5,10,16-18H,6-9,11-15H2,1-2H3,(H,23,27)
InChIKeyZFVMTQIFMXTHFZ-UHFFFAOYSA-N
XLogP3.08
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.52
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (CID 127041480) is N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is CC(C)c1nc(C(=O)NCC2CCN(C3CCOCC3)CC2)c2ccccn12.
What is the InChIKey of N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is ZFVMTQIFMXTHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32N4O2/c1-16(2)21-24-20(19-5-3-4-10-26(19)21)22(27)23-15-17-6-11-25(12-7-17)18-8-13-28-14-9-18/h3-5,10,16-18H,6-9,11-15H2,1-2H3,(H,23,27).
What are the key properties of N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 384.52 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(oxan-4-yl)piperidin-4-yl]methyl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 127041480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).