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

C21H30N4O2 — CID 127042085

IUPACN-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NC2CCN(C3CCOCC3)CC2)c2ccccn12
InChIInChI=1S/C21H30N4O2/c1-15(2)20-23-19(18-5-3-4-10-25(18)20)21(26)22-16-6-11-24(12-7-16)17-8-13-27-14-9-17/h3-5,10,15-17H,6-9,11-14H2,1-2H3,(H,22,26)
InChIKeyURQWYRTVALYSKP-UHFFFAOYSA-N
MW370.50 g/mol
LogP2.83
Rot. Bonds4

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

N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 127042085) has the molecular formula C21H30N4O2 and a molecular weight of 370.50 g/mol. Its IUPAC name is N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID127042085
Molecular FormulaC21H30N4O2
Molecular Weight370.50 g/mol
Exact Mass370.24
IUPAC NameN-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NC2CCN(C3CCOCC3)CC2)c2ccccn12
InChIInChI=1S/C21H30N4O2/c1-15(2)20-23-19(18-5-3-4-10-25(18)20)21(26)22-16-6-11-24(12-7-16)17-8-13-27-14-9-17/h3-5,10,15-17H,6-9,11-14H2,1-2H3,(H,22,26)
InChIKeyURQWYRTVALYSKP-UHFFFAOYSA-N
XLogP2.83
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 52.83
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]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (CID 127042085) is N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is CC(C)c1nc(C(=O)NC2CCN(C3CCOCC3)CC2)c2ccccn12.
What is the InChIKey of N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is URQWYRTVALYSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O2/c1-15(2)20-23-19(18-5-3-4-10-25(18)20)21(26)22-16-6-11-24(12-7-16)17-8-13-27-14-9-17/h3-5,10,15-17H,6-9,11-14H2,1-2H3,(H,22,26).
What are the key properties of N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
N-[1-(oxan-4-yl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 370.50 g/mol, XLogP of 2.83, 4 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]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 127042085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).