N-(1H-pyrazol-4-yl)morpholine-4-carboxamide

C8H12N4O2 — CID 20784954

IUPACN-(1H-pyrazol-4-yl)morpholine-4-carboxamide
SMILESO=C(Nc1cn[nH]c1)N1CCOCC1
InChIInChI=1S/C8H12N4O2/c13-8(11-7-5-9-10-6-7)12-1-3-14-4-2-12/h5-6H,1-4H2,(H,9,10)(H,11,13)
InChIKeyZIEXOURPGYEKPX-UHFFFAOYSA-N
MW196.21 g/mol
LogP0.27
Rot. Bonds1

About N-(1H-pyrazol-4-yl)morpholine-4-carboxamide

N-(1H-pyrazol-4-yl)morpholine-4-carboxamide (PubChem CID 20784954) has the molecular formula C8H12N4O2 and a molecular weight of 196.21 g/mol. Its IUPAC name is N-(1H-pyrazol-4-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrazol-4-yl)morpholine-4-carboxamide
PubChem CID20784954
Molecular FormulaC8H12N4O2
Molecular Weight196.21 g/mol
Exact Mass196.10
IUPAC NameN-(1H-pyrazol-4-yl)morpholine-4-carboxamide
SMILESO=C(Nc1cn[nH]c1)N1CCOCC1
InChIInChI=1S/C8H12N4O2/c13-8(11-7-5-9-10-6-7)12-1-3-14-4-2-12/h5-6H,1-4H2,(H,9,10)(H,11,13)
InChIKeyZIEXOURPGYEKPX-UHFFFAOYSA-N
XLogP0.27
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrazol-4-yl)morpholine-4-carboxamide?
The IUPAC name of N-(1H-pyrazol-4-yl)morpholine-4-carboxamide (CID 20784954) is N-(1H-pyrazol-4-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(1H-pyrazol-4-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(1H-pyrazol-4-yl)morpholine-4-carboxamide is O=C(Nc1cn[nH]c1)N1CCOCC1.
What is the InChIKey of N-(1H-pyrazol-4-yl)morpholine-4-carboxamide?
The InChIKey is ZIEXOURPGYEKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O2/c13-8(11-7-5-9-10-6-7)12-1-3-14-4-2-12/h5-6H,1-4H2,(H,9,10)(H,11,13).
What are the key properties of N-(1H-pyrazol-4-yl)morpholine-4-carboxamide?
N-(1H-pyrazol-4-yl)morpholine-4-carboxamide has a molecular weight of 196.21 g/mol, XLogP of 0.27, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrazol-4-yl)morpholine-4-carboxamide is sourced from PubChem (CID 20784954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).