[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone

C19H26N4O2 — CID 70772033

IUPAC[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESC[C@@H]1CN(C2CCN(C(=O)c3cnn4ccccc34)CC2)C[C@H](C)O1
InChIInChI=1S/C19H26N4O2/c1-14-12-22(13-15(2)25-14)16-6-9-21(10-7-16)19(24)17-11-20-23-8-4-3-5-18(17)23/h3-5,8,11,14-16H,6-7,9-10,12-13H2,1-2H3/t14-,15+
InChIKeyNLXWYMSAKDZKAL-GASCZTMLSA-N
MW342.44 g/mol
LogP2.05
Rot. Bonds2

About [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone

[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone (PubChem CID 70772033) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone.

Molecular Properties

Compound Name[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
PubChem CID70772033
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC Name[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESC[C@@H]1CN(C2CCN(C(=O)c3cnn4ccccc34)CC2)C[C@H](C)O1
InChIInChI=1S/C19H26N4O2/c1-14-12-22(13-15(2)25-14)16-6-9-21(10-7-16)19(24)17-11-20-23-8-4-3-5-18(17)23/h3-5,8,11,14-16H,6-7,9-10,12-13H2,1-2H3/t14-,15+
InChIKeyNLXWYMSAKDZKAL-GASCZTMLSA-N
XLogP2.05
TPSA50.08 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The IUPAC name of [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone (CID 70772033) is [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone.
What is the SMILES notation for [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The canonical SMILES for [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone is C[C@@H]1CN(C2CCN(C(=O)c3cnn4ccccc34)CC2)C[C@H](C)O1.
What is the InChIKey of [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The InChIKey is NLXWYMSAKDZKAL-GASCZTMLSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-14-12-22(13-15(2)25-14)16-6-9-21(10-7-16)19(24)17-11-20-23-8-4-3-5-18(17)23/h3-5,8,11,14-16H,6-7,9-10,12-13H2,1-2H3/t14-,15+.
What are the key properties of [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone has a molecular weight of 342.44 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]piperidin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone is sourced from PubChem (CID 70772033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).