4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine

Name: 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₃H₂₃N₃O — CID 118288835

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine

SMILESCc1cnn(C(C)(C)CN2CCOCC2)c1C

InChIInChI=1S/C13H23N3O/c1-11-9-14-16(12(11)2)13(3,4)10-15-5-7-17-8-6-15/h9H,5-8,10H2,1-4H3

InChIKeyDLUJDUGLWDJRBH-UHFFFAOYSA-N

MW237.35 g/mol

LogP1.57

Rot. Bonds3

About 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine

4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine (PubChem CID 118288835) has the molecular formula C₁₃H₂₃N₃O and a molecular weight of 237.35 g/mol. Its IUPAC name is 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine.

Molecular Properties

Compound Name	4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine
PubChem CID	118288835
Molecular Formula	C₁₃H₂₃N₃O
Molecular Weight	237.35 g/mol
Exact Mass	237.18
IUPAC Name	4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine
SMILES	Cc1cnn(C(C)(C)CN2CCOCC2)c1C
InChI	InChI=1S/C13H23N3O/c1-11-9-14-16(12(11)2)13(3,4)10-15-5-7-17-8-6-15/h9H,5-8,10H2,1-4H3
InChIKey	DLUJDUGLWDJRBH-UHFFFAOYSA-N
XLogP	1.57
TPSA	30.29 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	3
Heavy Atoms	17
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	237.35
LogP ≤ 5	1.57
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine?

The IUPAC name of 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine (CID 118288835) is 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine.

What is the SMILES notation for 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine?

The canonical SMILES for 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine is Cc1cnn(C(C)(C)CN2CCOCC2)c1C.

What is the InChIKey of 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine?

The InChIKey is DLUJDUGLWDJRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O/c1-11-9-14-16(12(11)2)13(3,4)10-15-5-7-17-8-6-15/h9H,5-8,10H2,1-4H3.

What are the key properties of 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine?

4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine has a molecular weight of 237.35 g/mol, XLogP of 1.57, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(4,5-dimethylpyrazol-1-yl)-2-methylpropyl]morpholine is sourced from PubChem (CID 118288835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 118288835 — identifiers, structure, computed properties (public domain)

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