N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine

C13H26N2O2 — CID 116911069

IUPACN,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine
SMILESCN(C)C(CC1COCCN1)C1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-15(2)13(11-3-6-16-7-4-11)9-12-10-17-8-5-14-12/h11-14H,3-10H2,1-2H3
InChIKeyUPHDMKFGZBSBJN-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.72
Rot. Bonds4

About N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine

N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine (PubChem CID 116911069) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine
PubChem CID116911069
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine
SMILESCN(C)C(CC1COCCN1)C1CCOCC1
InChIInChI=1S/C13H26N2O2/c1-15(2)13(11-3-6-16-7-4-11)9-12-10-17-8-5-14-12/h11-14H,3-10H2,1-2H3
InChIKeyUPHDMKFGZBSBJN-UHFFFAOYSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 20811826
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3-(propan-2-yloxymethyl)morpholine
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N-(cyclopentylmethyl)-N-methyl-1-morpholin-3-ylpropan-2-amine
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5-(2-methylpropyl)-1,4-oxazepane
CID 129066958
N,N,N'-trimethyl-N'-(1-morpholin-3-ylpropan-2-yl)propane-1,3-diamine
CID 113462221
N-methyl-N-(2-morpholin-3-ylethyl)oxolan-3-amine
CID 82739178
3-(bromomethyl)morpholine
CID 70577689
3-prop-2-enyl-(313C)1,4-oxazinane
CID 173137376
N-ethyl-N-(1-morpholin-3-ylpropan-2-yl)cyclohexanamine
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3-(dimethylamino)-3-(oxan-4-yl)propanenitrile
CID 116910000

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine (CID 116911069) is N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine is CN(C)C(CC1COCCN1)C1CCOCC1.
What is the InChIKey of N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine?
The InChIKey is UPHDMKFGZBSBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-15(2)13(11-3-6-16-7-4-11)9-12-10-17-8-5-14-12/h11-14H,3-10H2,1-2H3.
What are the key properties of N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine?
N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine has a molecular weight of 242.36 g/mol, XLogP of 0.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-morpholin-3-yl-1-(oxan-4-yl)ethanamine is sourced from PubChem (CID 116911069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).