N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine

C12H22N4O — CID 43675922

IUPACN-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
SMILESCC(CN1CCOCC1)NCc1ccnn1C
InChIInChI=1S/C12H22N4O/c1-11(10-16-5-7-17-8-6-16)13-9-12-3-4-14-15(12)2/h3-4,11,13H,5-10H2,1-2H3
InChIKeyJETGDKWOFZIBOD-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.23
Rot. Bonds5

About N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine

N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine (PubChem CID 43675922) has the molecular formula C12H22N4O and a molecular weight of 238.33 g/mol. Its IUPAC name is N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
PubChem CID43675922
Molecular FormulaC12H22N4O
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC NameN-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
SMILESCC(CN1CCOCC1)NCc1ccnn1C
InChIInChI=1S/C12H22N4O/c1-11(10-16-5-7-17-8-6-16)13-9-12-3-4-14-15(12)2/h3-4,11,13H,5-10H2,1-2H3
InChIKeyJETGDKWOFZIBOD-UHFFFAOYSA-N
XLogP0.23
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-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 N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine (CID 43675922) is N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine.
What is the SMILES notation for N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The canonical SMILES for N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine is CC(CN1CCOCC1)NCc1ccnn1C.
What is the InChIKey of N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
The InChIKey is JETGDKWOFZIBOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N4O/c1-11(10-16-5-7-17-8-6-16)13-9-12-3-4-14-15(12)2/h3-4,11,13H,5-10H2,1-2H3.
What are the key properties of N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine?
N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine has a molecular weight of 238.33 g/mol, XLogP of 0.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine is sourced from PubChem (CID 43675922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).