1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

C11H18N4O2 — CID 18766896

IUPAC1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide
SMILESNC(=O)c1ccn(CCCN2CCOCC2)n1
InChIInChI=1S/C11H18N4O2/c12-11(16)10-2-5-15(13-10)4-1-3-14-6-8-17-9-7-14/h2,5H,1,3-4,6-9H2,(H2,12,16)
InChIKeyFTRLEQDDLOCXKT-UHFFFAOYSA-N
MW238.29 g/mol
LogP-0.30
Rot. Bonds5

About 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide

1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide (PubChem CID 18766896) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide.

Molecular Properties

Compound Name1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide
PubChem CID18766896
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide
SMILESNC(=O)c1ccn(CCCN2CCOCC2)n1
InChIInChI=1S/C11H18N4O2/c12-11(16)10-2-5-15(13-10)4-1-3-14-6-8-17-9-7-14/h2,5H,1,3-4,6-9H2,(H2,12,16)
InChIKeyFTRLEQDDLOCXKT-UHFFFAOYSA-N
XLogP-0.30
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide?
The IUPAC name of 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide (CID 18766896) is 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide.
What is the SMILES notation for 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide?
The canonical SMILES for 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide is NC(=O)c1ccn(CCCN2CCOCC2)n1.
What is the InChIKey of 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide?
The InChIKey is FTRLEQDDLOCXKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c12-11(16)10-2-5-15(13-10)4-1-3-14-6-8-17-9-7-14/h2,5H,1,3-4,6-9H2,(H2,12,16).
What are the key properties of 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide?
1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of -0.30, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-morpholin-4-ylpropyl)pyrazole-3-carboxamide is sourced from PubChem (CID 18766896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).