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

C20H29FN4O — CID 127039507

IUPACN-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NC2CCN(CC(C)(C)F)CC2)c2ccccn12
InChIInChI=1S/C20H29FN4O/c1-14(2)18-23-17(16-7-5-6-10-25(16)18)19(26)22-15-8-11-24(12-9-15)13-20(3,4)21/h5-7,10,14-15H,8-9,11-13H2,1-4H3,(H,22,26)
InChIKeyQDOZAVATYPZZCI-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.40
Rot. Bonds5

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

N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (PubChem CID 127039507) has the molecular formula C20H29FN4O and a molecular weight of 360.48 g/mol. Its IUPAC name is N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
PubChem CID127039507
Molecular FormulaC20H29FN4O
Molecular Weight360.48 g/mol
Exact Mass360.23
IUPAC NameN-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide
SMILESCC(C)c1nc(C(=O)NC2CCN(CC(C)(C)F)CC2)c2ccccn12
InChIInChI=1S/C20H29FN4O/c1-14(2)18-23-17(16-7-5-6-10-25(16)18)19(26)22-15-8-11-24(12-9-15)13-20(3,4)21/h5-7,10,14-15H,8-9,11-13H2,1-4H3,(H,22,26)
InChIKeyQDOZAVATYPZZCI-UHFFFAOYSA-N
XLogP3.40
TPSA49.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The IUPAC name of N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide (CID 127039507) is N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide.
What is the SMILES notation for N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The canonical SMILES for N-[1-(2-fluoro-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)F)CC2)c2ccccn12.
What is the InChIKey of N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
The InChIKey is QDOZAVATYPZZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29FN4O/c1-14(2)18-23-17(16-7-5-6-10-25(16)18)19(26)22-15-8-11-24(12-9-15)13-20(3,4)21/h5-7,10,14-15H,8-9,11-13H2,1-4H3,(H,22,26).
What are the key properties of N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide?
N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide has a molecular weight of 360.48 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-3-propan-2-ylimidazo[1,5-a]pyridine-1-carboxamide is sourced from PubChem (CID 127039507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).