1-morpholin-2-ylpropane-1,2-diol;hydrochloride

C7H16ClNO3 — CID 174973290

IUPAC1-morpholin-2-ylpropane-1,2-diol;hydrochloride
SMILESCC(O)C(O)C1CNCCO1.Cl
InChIInChI=1S/C7H15NO3.ClH/c1-5(9)7(10)6-4-8-2-3-11-6;/h5-10H,2-4H2,1H3;1H
InChIKeyKXHUQJSPOVTLHD-UHFFFAOYSA-N
MW197.66 g/mol
LogP-0.86
Rot. Bonds2

About 1-morpholin-2-ylpropane-1,2-diol;hydrochloride

1-morpholin-2-ylpropane-1,2-diol;hydrochloride (PubChem CID 174973290) has the molecular formula C7H16ClNO3 and a molecular weight of 197.66 g/mol. Its IUPAC name is 1-morpholin-2-ylpropane-1,2-diol;hydrochloride.

Molecular Properties

Compound Name1-morpholin-2-ylpropane-1,2-diol;hydrochloride
PubChem CID174973290
Molecular FormulaC7H16ClNO3
Molecular Weight197.66 g/mol
Exact Mass197.08
IUPAC Name1-morpholin-2-ylpropane-1,2-diol;hydrochloride
SMILESCC(O)C(O)C1CNCCO1.Cl
InChIInChI=1S/C7H15NO3.ClH/c1-5(9)7(10)6-4-8-2-3-11-6;/h5-10H,2-4H2,1H3;1H
InChIKeyKXHUQJSPOVTLHD-UHFFFAOYSA-N
XLogP-0.86
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.66
LogP ≤ 5-0.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 1-morpholin-2-ylpropane-1,2-diol;hydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

1-(1-morpholin-2-ylethoxy)ethanol
CID 18790491
(2R)-2-[(2S)-butan-2-yl]morpholine
CID 57122298
2-(1-morpholin-2-ylethyl)guanidine;hydrochloride
CID 174836118
(2S)-2-(difluoromethyl)morpholine;hydrochloride
CID 140765944
2,2,2-trifluoro-1-morpholin-2-ylethanol
CID 175950146
O-[1-[(2R)-morpholin-2-yl]ethyl]hydroxylamine
CID 89160024
(2R)-2-(difluoromethyl)morpholine
CID 97296988
2-[1-(2-methylprop-2-enoxy)ethyl]morpholine
CID 70372421
(R)-morpholin-2-yl(phenyl)methanol
CID 69108289
1-(oxolan-2-yl)propane-1,2-diol
CID 142778097
1-morpholin-2-ylethyl prop-2-enoate
CID 22556289
2-morpholin-2-ylbutanamide
CID 174480619

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-2-ylpropane-1,2-diol;hydrochloride?
The IUPAC name of 1-morpholin-2-ylpropane-1,2-diol;hydrochloride (CID 174973290) is 1-morpholin-2-ylpropane-1,2-diol;hydrochloride.
What is the SMILES notation for 1-morpholin-2-ylpropane-1,2-diol;hydrochloride?
The canonical SMILES for 1-morpholin-2-ylpropane-1,2-diol;hydrochloride is CC(O)C(O)C1CNCCO1.Cl.
What is the InChIKey of 1-morpholin-2-ylpropane-1,2-diol;hydrochloride?
The InChIKey is KXHUQJSPOVTLHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO3.ClH/c1-5(9)7(10)6-4-8-2-3-11-6;/h5-10H,2-4H2,1H3;1H.
What are the key properties of 1-morpholin-2-ylpropane-1,2-diol;hydrochloride?
1-morpholin-2-ylpropane-1,2-diol;hydrochloride has a molecular weight of 197.66 g/mol, XLogP of -0.86, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-2-ylpropane-1,2-diol;hydrochloride is sourced from PubChem (CID 174973290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).