4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide

C15H21F3N4O2 — CID 128788820

IUPAC4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCOC1(C(F)(F)F)CCN(C(=O)Nc2cc3n(n2)CCCC3)CC1
InChIInChI=1S/C15H21F3N4O2/c1-24-14(15(16,17)18)5-8-21(9-6-14)13(23)19-12-10-11-4-2-3-7-22(11)20-12/h10H,2-9H2,1H3,(H,19,20,23)
InChIKeyDELLZCCZUOIQOY-UHFFFAOYSA-N
MW346.35 g/mol
LogP2.79
Rot. Bonds2

About 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide

4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide (PubChem CID 128788820) has the molecular formula C15H21F3N4O2 and a molecular weight of 346.35 g/mol. Its IUPAC name is 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
PubChem CID128788820
Molecular FormulaC15H21F3N4O2
Molecular Weight346.35 g/mol
Exact Mass346.16
IUPAC Name4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide
SMILESCOC1(C(F)(F)F)CCN(C(=O)Nc2cc3n(n2)CCCC3)CC1
InChIInChI=1S/C15H21F3N4O2/c1-24-14(15(16,17)18)5-8-21(9-6-14)13(23)19-12-10-11-4-2-3-7-22(11)20-12/h10H,2-9H2,1H3,(H,19,20,23)
InChIKeyDELLZCCZUOIQOY-UHFFFAOYSA-N
XLogP2.79
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.35
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The IUPAC name of 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide (CID 128788820) is 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide is COC1(C(F)(F)F)CCN(C(=O)Nc2cc3n(n2)CCCC3)CC1.
What is the InChIKey of 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
The InChIKey is DELLZCCZUOIQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21F3N4O2/c1-24-14(15(16,17)18)5-8-21(9-6-14)13(23)19-12-10-11-4-2-3-7-22(11)20-12/h10H,2-9H2,1H3,(H,19,20,23).
What are the key properties of 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide?
4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide has a molecular weight of 346.35 g/mol, XLogP of 2.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)-4-(trifluoromethyl)piperidine-1-carboxamide is sourced from PubChem (CID 128788820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).