4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine

C13H21N5O — CID 135952169

IUPAC4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine
SMILESCn1ncc2[nH]c(C(C)(C)CN3CCOCC3)nc21
InChIInChI=1S/C13H21N5O/c1-13(2,9-18-4-6-19-7-5-18)12-15-10-8-14-17(3)11(10)16-12/h8H,4-7,9H2,1-3H3,(H,15,16)
InChIKeyCFWCMGNYRDSZTD-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.91
Rot. Bonds3

About 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine

4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine (PubChem CID 135952169) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine
PubChem CID135952169
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC Name4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine
SMILESCn1ncc2[nH]c(C(C)(C)CN3CCOCC3)nc21
InChIInChI=1S/C13H21N5O/c1-13(2,9-18-4-6-19-7-5-18)12-15-10-8-14-17(3)11(10)16-12/h8H,4-7,9H2,1-3H3,(H,15,16)
InChIKeyCFWCMGNYRDSZTD-UHFFFAOYSA-N
XLogP0.91
TPSA58.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine 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 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine?
The IUPAC name of 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine (CID 135952169) is 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine.
What is the SMILES notation for 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine?
The canonical SMILES for 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine is Cn1ncc2[nH]c(C(C)(C)CN3CCOCC3)nc21.
What is the InChIKey of 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine?
The InChIKey is CFWCMGNYRDSZTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-13(2,9-18-4-6-19-7-5-18)12-15-10-8-14-17(3)11(10)16-12/h8H,4-7,9H2,1-3H3,(H,15,16).
What are the key properties of 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine?
4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine has a molecular weight of 263.34 g/mol, XLogP of 0.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methyl-2-(1-methyl-4H-imidazo[4,5-d]pyrazol-5-yl)propyl]morpholine is sourced from PubChem (CID 135952169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).