3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine

C14H18N4O — CID 82171782

IUPAC3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
SMILESNc1cc(CN2CCOCC2)nn1-c1ccccc1
InChIInChI=1S/C14H18N4O/c15-14-10-12(11-17-6-8-19-9-7-17)16-18(14)13-4-2-1-3-5-13/h1-5,10H,6-9,11,15H2
InChIKeySRBBOUODFAYVGU-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.29
Rot. Bonds3

About 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine

3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine (PubChem CID 82171782) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine.

Molecular Properties

Compound Name3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
PubChem CID82171782
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine
SMILESNc1cc(CN2CCOCC2)nn1-c1ccccc1
InChIInChI=1S/C14H18N4O/c15-14-10-12(11-17-6-8-19-9-7-17)16-18(14)13-4-2-1-3-5-13/h1-5,10H,6-9,11,15H2
InChIKeySRBBOUODFAYVGU-UHFFFAOYSA-N
XLogP1.29
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
The IUPAC name of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine (CID 82171782) is 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine.
What is the SMILES notation for 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
The canonical SMILES for 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine is Nc1cc(CN2CCOCC2)nn1-c1ccccc1.
What is the InChIKey of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
The InChIKey is SRBBOUODFAYVGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-14-10-12(11-17-6-8-19-9-7-17)16-18(14)13-4-2-1-3-5-13/h1-5,10H,6-9,11,15H2.
What are the key properties of 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine?
3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine has a molecular weight of 258.32 g/mol, XLogP of 1.29, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(morpholin-4-ylmethyl)-1-phenylpyrazol-5-amine is sourced from PubChem (CID 82171782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).