2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol

C11H24N2O2 — CID 60886953

IUPAC2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol
SMILESCC(C)(O)CNCCCN1CCOCC1
InChIInChI=1S/C11H24N2O2/c1-11(2,14)10-12-4-3-5-13-6-8-15-9-7-13/h12,14H,3-10H2,1-2H3
InChIKeyCEJKDFGSLXTQDL-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.07
Rot. Bonds6

About 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol

2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol (PubChem CID 60886953) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol.

Molecular Properties

Compound Name2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol
PubChem CID60886953
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol
SMILESCC(C)(O)CNCCCN1CCOCC1
InChIInChI=1S/C11H24N2O2/c1-11(2,14)10-12-4-3-5-13-6-8-15-9-7-13/h12,14H,3-10H2,1-2H3
InChIKeyCEJKDFGSLXTQDL-UHFFFAOYSA-N
XLogP0.07
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-methyl-1-(3-pyrrolidin-1-ylpropylamino)propan-2-ol
CID 62989599
ethane;N-ethyl-3-morpholin-4-ylpropan-1-amine
CID 170595450
5-(3-morpholin-4-ylpropylamino)pentan-1-ol
CID 62227528
2-methyl-4-morpholin-4-ylbutan-2-ol
CID 79316740
1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone
CID 43091152
N-(3-morpholin-4-ylpropyl)but-2-yn-1-amine
CID 62309941
2-methyl-1-(3-pyrrolidin-1-ylpropylamino)butan-2-ol
CID 65111581
2-methyl-1-[methyl(3-morpholin-4-ylpropyl)amino]propan-2-ol
CID 111488087
N-[(4-tert-butylphenyl)methyl]-3-morpholin-4-ylpropan-1-amine
CID 3152140
3,3-dimethyl-N-(3-morpholin-4-ylpropyl)butanamide
CID 2225348
5-morpholin-4-yl-N-propylpentan-1-amine
CID 62437718
N'-tert-butyl-N'-ethyl-N-(3-morpholin-4-ylpropyl)oxamide
CID 108518511

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol?
The IUPAC name of 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol (CID 60886953) is 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol.
What is the SMILES notation for 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol?
The canonical SMILES for 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol is CC(C)(O)CNCCCN1CCOCC1.
What is the InChIKey of 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol?
The InChIKey is CEJKDFGSLXTQDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11(2,14)10-12-4-3-5-13-6-8-15-9-7-13/h12,14H,3-10H2,1-2H3.
What are the key properties of 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol?
2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol has a molecular weight of 216.32 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol is sourced from PubChem (CID 60886953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).