5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine

C8H14N4O — CID 91491094

IUPAC5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine
SMILESNc1cc(CN2CCOCC2)[nH]n1
InChIInChI=1S/C8H14N4O/c9-8-5-7(10-11-8)6-12-1-3-13-4-2-12/h5H,1-4,6H2,(H3,9,10,11)
InChIKeyAZGXDUCDMZEQII-UHFFFAOYSA-N
MW182.23 g/mol
LogP-0.18
Rot. Bonds2

About 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine

5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine (PubChem CID 91491094) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine
PubChem CID91491094
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine
SMILESNc1cc(CN2CCOCC2)[nH]n1
InChIInChI=1S/C8H14N4O/c9-8-5-7(10-11-8)6-12-1-3-13-4-2-12/h5H,1-4,6H2,(H3,9,10,11)
InChIKeyAZGXDUCDMZEQII-UHFFFAOYSA-N
XLogP-0.18
TPSA67.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine (CID 91491094) is 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine is Nc1cc(CN2CCOCC2)[nH]n1.
What is the InChIKey of 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine?
The InChIKey is AZGXDUCDMZEQII-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c9-8-5-7(10-11-8)6-12-1-3-13-4-2-12/h5H,1-4,6H2,(H3,9,10,11).
What are the key properties of 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine?
5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine has a molecular weight of 182.23 g/mol, XLogP of -0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(morpholin-4-ylmethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 91491094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).