NEZWADBQASQPGT-UHFFFAOYSA-N

Name: NEZWADBQASQPGT-UHFFFAOYSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₈H₂₀Cl₂N₂O — CID 118511951

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

IUPAC2-methyl-1-morpholin-4-ylpropan-2-amine;dihydrochloride

SMILESCC(C)(N)CN1CCOCC1.Cl.Cl

InChIInChI=1S/C8H18N2O.2ClH/c1-8(2,9)7-10-3-5-11-6-4-10;;/h3-7,9H2,1-2H3;2*1H

InChIKeyNEZWADBQASQPGT-UHFFFAOYSA-N

MW231.17 g/mol

LogP0.90

Rot. Bonds2

About NEZWADBQASQPGT-UHFFFAOYSA-N

NEZWADBQASQPGT-UHFFFAOYSA-N (PubChem CID 118511951) has the molecular formula C₈H₂₀Cl₂N₂O and a molecular weight of 231.17 g/mol. Its IUPAC name is 2-methyl-1-morpholin-4-ylpropan-2-amine;dihydrochloride.

Molecular Properties

Compound Name	NEZWADBQASQPGT-UHFFFAOYSA-N
PubChem CID	118511951
Molecular Formula	C₈H₂₀Cl₂N₂O
Molecular Weight	231.17 g/mol
Exact Mass	230.10
IUPAC Name	2-methyl-1-morpholin-4-ylpropan-2-amine;dihydrochloride
SMILES	CC(C)(N)CN1CCOCC1.Cl.Cl
InChI	InChI=1S/C8H18N2O.2ClH/c1-8(2,9)7-10-3-5-11-6-4-10;;/h3-7,9H2,1-2H3;2*1H
InChIKey	NEZWADBQASQPGT-UHFFFAOYSA-N
XLogP	0.90
TPSA	38.49 Å²
H-Bond Donors	1
H-Bond Acceptors	3
Rotatable Bonds	2
Heavy Atoms	13
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	231.17
LogP ≤ 5	0.90
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of NEZWADBQASQPGT-UHFFFAOYSA-N?

The IUPAC name of NEZWADBQASQPGT-UHFFFAOYSA-N (CID 118511951) is 2-methyl-1-morpholin-4-ylpropan-2-amine;dihydrochloride.

What is the SMILES notation for NEZWADBQASQPGT-UHFFFAOYSA-N?

The canonical SMILES for NEZWADBQASQPGT-UHFFFAOYSA-N is CC(C)(N)CN1CCOCC1.Cl.Cl.

What is the InChIKey of NEZWADBQASQPGT-UHFFFAOYSA-N?

The InChIKey is NEZWADBQASQPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O.2ClH/c1-8(2,9)7-10-3-5-11-6-4-10;;/h3-7,9H2,1-2H3;2*1H.

What are the key properties of NEZWADBQASQPGT-UHFFFAOYSA-N?

NEZWADBQASQPGT-UHFFFAOYSA-N has a molecular weight of 231.17 g/mol, XLogP of 0.90, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for NEZWADBQASQPGT-UHFFFAOYSA-N is sourced from PubChem (CID 118511951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 118511951 — identifiers, structure, computed properties (public domain)

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