1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol

C11H24N2O2 — CID 61020835

IUPAC1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol
SMILESCN(C)CC(O)CNCC1CCCOC1
InChIInChI=1S/C11H24N2O2/c1-13(2)8-11(14)7-12-6-10-4-3-5-15-9-10/h10-12,14H,3-9H2,1-2H3
InChIKeyOEUFDZOXCRJQBT-UHFFFAOYSA-N
MW216.32 g/mol
LogP-0.07
Rot. Bonds6

About 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol

1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol (PubChem CID 61020835) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol.

Molecular Properties

Compound Name1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol
PubChem CID61020835
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol
SMILESCN(C)CC(O)CNCC1CCCOC1
InChIInChI=1S/C11H24N2O2/c1-13(2)8-11(14)7-12-6-10-4-3-5-15-9-10/h10-12,14H,3-9H2,1-2H3
InChIKeyOEUFDZOXCRJQBT-UHFFFAOYSA-N
XLogP-0.07
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 ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(3S)-oxan-3-yl]-N-[[(3S)-oxan-3-yl]methyl]methanamine
CID 129371205
2-N,2-N,2-trimethyl-1-N-(oxan-3-ylmethyl)propane-1,2-diamine
CID 63737020
1-cyclopentyl-N-(oxan-3-ylmethyl)methanamine
CID 61342622
1-chloro-3-[methyl(oxan-3-ylmethyl)amino]propan-2-ol
CID 112561683
2-(oxan-3-ylmethylamino)-1-(4-propan-2-ylphenyl)ethanol
CID 61019224
2-amino-3-(oxan-3-ylmethylamino)propanamide
CID 103242267
methyl 2-bromo-3-(oxan-3-ylmethylamino)propanoate
CID 103242246
2-(dimethylamino)-1-(oxan-3-yl)ethanol
CID 107136154
N,N-dimethyl-1-[(3R)-oxan-3-yl]methanamine
CID 175701227
N-methylsulfanyl-1-(oxan-3-yl)methanamine
CID 123744693
N,N-diethyl-N'-(oxan-3-ylmethyl)-1-phenylethane-1,2-diamine
CID 63736846
N-(oxan-3-ylmethyl)butan-1-amine
CID 61020591

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol?
The IUPAC name of 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol (CID 61020835) is 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol.
What is the SMILES notation for 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol?
The canonical SMILES for 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol is CN(C)CC(O)CNCC1CCCOC1.
What is the InChIKey of 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol?
The InChIKey is OEUFDZOXCRJQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-13(2)8-11(14)7-12-6-10-4-3-5-15-9-10/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol?
1-(dimethylamino)-3-(oxan-3-ylmethylamino)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 1-(dimethylamino)-3-(oxan-3-ylmethylamino)propan-2-ol is sourced from PubChem (CID 61020835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).