N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide

C19H27N5O2 — CID 55831374

IUPACN-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)NCCN2CC(C)OC(C)C2)cnn1-c1ccccn1
InChIInChI=1S/C19H27N5O2/c1-4-17-16(11-22-24(17)18-7-5-6-8-20-18)19(25)21-9-10-23-12-14(2)26-15(3)13-23/h5-8,11,14-15H,4,9-10,12-13H2,1-3H3,(H,21,25)
InChIKeyGIEMQZHWPXHZSB-UHFFFAOYSA-N
MW357.46 g/mol
LogP1.67
Rot. Bonds6

About N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide

N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 55831374) has the molecular formula C19H27N5O2 and a molecular weight of 357.46 g/mol. Its IUPAC name is N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID55831374
Molecular FormulaC19H27N5O2
Molecular Weight357.46 g/mol
Exact Mass357.22
IUPAC NameN-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCCc1c(C(=O)NCCN2CC(C)OC(C)C2)cnn1-c1ccccn1
InChIInChI=1S/C19H27N5O2/c1-4-17-16(11-22-24(17)18-7-5-6-8-20-18)19(25)21-9-10-23-12-14(2)26-15(3)13-23/h5-8,11,14-15H,4,9-10,12-13H2,1-3H3,(H,21,25)
InChIKeyGIEMQZHWPXHZSB-UHFFFAOYSA-N
XLogP1.67
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide (CID 55831374) is N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide is CCc1c(C(=O)NCCN2CC(C)OC(C)C2)cnn1-c1ccccn1.
What is the InChIKey of N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is GIEMQZHWPXHZSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O2/c1-4-17-16(11-22-24(17)18-7-5-6-8-20-18)19(25)21-9-10-23-12-14(2)26-15(3)13-23/h5-8,11,14-15H,4,9-10,12-13H2,1-3H3,(H,21,25).
What are the key properties of N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide?
N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 357.46 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-dimethylmorpholin-4-yl)ethyl]-5-ethyl-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 55831374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).