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

C20H30N4O2 — CID 127038726

IUPACN-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NC2CCN(CC(C)(C)O)CC2)c2ccccn12
InChIInChI=1S/C20H30N4O2/c1-14(2)18-22-17(16-7-5-6-10-24(16)18)19(25)21-15-8-11-23(12-9-15)13-20(3,4)26/h5-7,10,14-15,26H,8-9,11-13H2,1-4H3,(H,21,25)
InChIKeyGESRNVRYBAKLFW-UHFFFAOYSA-N
MW358.49 g/mol
LogP2.42
Rot. Bonds5

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

N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 127038726) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID127038726
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC NameN-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NC2CCN(CC(C)(C)O)CC2)c2ccccn12
InChIInChI=1S/C20H30N4O2/c1-14(2)18-22-17(16-7-5-6-10-24(16)18)19(25)21-15-8-11-23(12-9-15)13-20(3,4)26/h5-7,10,14-15,26H,8-9,11-13H2,1-4H3,(H,21,25)
InChIKeyGESRNVRYBAKLFW-UHFFFAOYSA-N
XLogP2.42
TPSA69.87 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (CID 127038726) is N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is CC(C)c1nc(C(=O)NC2CCN(CC(C)(C)O)CC2)c2ccccn12.
What is the InChIKey of N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is GESRNVRYBAKLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c1-14(2)18-22-17(16-7-5-6-10-24(16)18)19(25)21-15-8-11-23(12-9-15)13-20(3,4)26/h5-7,10,14-15,26H,8-9,11-13H2,1-4H3,(H,21,25).
What are the key properties of N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 358.49 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-hydroxy-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 127038726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).