N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide

C16H27N5O2 — CID 86784707

IUPACN-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
SMILESCC(NC(=O)N1CCCCC1c1cn[nH]c1)C1CN(C)CCO1
InChIInChI=1S/C16H27N5O2/c1-12(15-11-20(2)7-8-23-15)19-16(22)21-6-4-3-5-14(21)13-9-17-18-10-13/h9-10,12,14-15H,3-8,11H2,1-2H3,(H,17,18)(H,19,22)
InChIKeyOATBAUVGGWNIJA-UHFFFAOYSA-N
MW321.43 g/mol
LogP1.37
Rot. Bonds3

About N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide

N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide (PubChem CID 86784707) has the molecular formula C16H27N5O2 and a molecular weight of 321.43 g/mol. Its IUPAC name is N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
PubChem CID86784707
Molecular FormulaC16H27N5O2
Molecular Weight321.43 g/mol
Exact Mass321.22
IUPAC NameN-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
SMILESCC(NC(=O)N1CCCCC1c1cn[nH]c1)C1CN(C)CCO1
InChIInChI=1S/C16H27N5O2/c1-12(15-11-20(2)7-8-23-15)19-16(22)21-6-4-3-5-14(21)13-9-17-18-10-13/h9-10,12,14-15H,3-8,11H2,1-2H3,(H,17,18)(H,19,22)
InChIKeyOATBAUVGGWNIJA-UHFFFAOYSA-N
XLogP1.37
TPSA73.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(2,5-dimethylthiophen-3-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 136521486
(2R)-N-[(1S)-1-(4-cyanophenyl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 98573372
(2R)-N-[1-methyl-3-[(2S)-oxolan-2-yl]pyrazol-5-yl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 124890525
N-[3-(2-methylpropanoylamino)propyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 75499708
N-(2-tert-butylpyrazol-3-yl)-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 154754412
(2R)-N-[(3R)-1,1-dioxothiolan-3-yl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 97252299
(2S)-N-[(1R,2R,4R)-7-oxabicyclo[2.2.1]heptan-2-yl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 129425227
(2S)-N-[(1S)-1-[(2S)-oxolan-2-yl]ethyl]-2-thiophen-3-ylpyrrolidine-1-carboxamide
CID 100836452
(2R)-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 99777080
N-[2-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 86784463
(2R)-N-[[(3R,9aR)-1,3,4,6,7,8,9,9a-octahydropyrido[2,1-c][1,4]oxazin-3-yl]methyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 99852891
N-[3-(propanoylamino)phenyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide
CID 75521565

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The IUPAC name of N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide (CID 86784707) is N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide.
What is the SMILES notation for N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The canonical SMILES for N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide is CC(NC(=O)N1CCCCC1c1cn[nH]c1)C1CN(C)CCO1.
What is the InChIKey of N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
The InChIKey is OATBAUVGGWNIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N5O2/c1-12(15-11-20(2)7-8-23-15)19-16(22)21-6-4-3-5-14(21)13-9-17-18-10-13/h9-10,12,14-15H,3-8,11H2,1-2H3,(H,17,18)(H,19,22).
What are the key properties of N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide?
N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide has a molecular weight of 321.43 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylmorpholin-2-yl)ethyl]-2-(1H-pyrazol-4-yl)piperidine-1-carboxamide is sourced from PubChem (CID 86784707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).