6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

C15H19F3N4O2 — CID 155871298

IUPAC6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
SMILESO=C(NCC(F)(F)F)c1ncn2c1CCC(C(=O)NCC1CC1)C2
InChIInChI=1S/C15H19F3N4O2/c16-15(17,18)7-20-14(24)12-11-4-3-10(6-22(11)8-21-12)13(23)19-5-9-1-2-9/h8-10H,1-7H2,(H,19,23)(H,20,24)
InChIKeyAGZPPZXTKDDLAC-UHFFFAOYSA-N
MW344.34 g/mol
LogP1.26
Rot. Bonds5

About 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide

6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (PubChem CID 155871298) has the molecular formula C15H19F3N4O2 and a molecular weight of 344.34 g/mol. Its IUPAC name is 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.

Molecular Properties

Compound Name6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
PubChem CID155871298
Molecular FormulaC15H19F3N4O2
Molecular Weight344.34 g/mol
Exact Mass344.15
IUPAC Name6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide
SMILESO=C(NCC(F)(F)F)c1ncn2c1CCC(C(=O)NCC1CC1)C2
InChIInChI=1S/C15H19F3N4O2/c16-15(17,18)7-20-14(24)12-11-4-3-10(6-22(11)8-21-12)13(23)19-5-9-1-2-9/h8-10H,1-7H2,(H,19,23)(H,20,24)
InChIKeyAGZPPZXTKDDLAC-UHFFFAOYSA-N
XLogP1.26
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.34
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
The IUPAC name of 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide (CID 155871298) is 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide.
What is the SMILES notation for 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
The canonical SMILES for 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is O=C(NCC(F)(F)F)c1ncn2c1CCC(C(=O)NCC1CC1)C2.
What is the InChIKey of 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
The InChIKey is AGZPPZXTKDDLAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N4O2/c16-15(17,18)7-20-14(24)12-11-4-3-10(6-22(11)8-21-12)13(23)19-5-9-1-2-9/h8-10H,1-7H2,(H,19,23)(H,20,24).
What are the key properties of 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide?
6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide has a molecular weight of 344.34 g/mol, XLogP of 1.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(cyclopropylmethyl)-1-N-(2,2,2-trifluoroethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,6-dicarboxamide is sourced from PubChem (CID 155871298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).