N-(3-morpholin-4-ylpropyl)oxan-4-amine

C12H24N2O2 — CID 18349139

IUPACN-(3-morpholin-4-ylpropyl)oxan-4-amine
SMILESC(CNC1CCOCC1)CN1CCOCC1
InChIInChI=1S/C12H24N2O2/c1(5-14-6-10-16-11-7-14)4-13-12-2-8-15-9-3-12/h12-13H,1-11H2
InChIKeyRIFGLNPGHOKYOA-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.48
Rot. Bonds5

About N-(3-morpholin-4-ylpropyl)oxan-4-amine

N-(3-morpholin-4-ylpropyl)oxan-4-amine (PubChem CID 18349139) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)oxan-4-amine.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)oxan-4-amine
PubChem CID18349139
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-(3-morpholin-4-ylpropyl)oxan-4-amine
SMILESC(CNC1CCOCC1)CN1CCOCC1
InChIInChI=1S/C12H24N2O2/c1(5-14-6-10-16-11-7-14)4-13-12-2-8-15-9-3-12/h12-13H,1-11H2
InChIKeyRIFGLNPGHOKYOA-UHFFFAOYSA-N
XLogP0.48
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[5-(1,4-oxazepan-4-yl)pentyl]cyclopropanamine
CID 62972668
N-(3-morpholin-4-ylpropyl)-4-propylcyclohexan-1-amine
CID 28672998
cis-(1S,3R)-3-methyl-N-(3-morpholin-4-ylpropyl)cyclopentan-1-amine
CID 30980577
N-(2-pyrrolidin-1-ylethyl)oxan-4-amine
CID 43608501
N-(3-morpholin-4-ylpropyl)-2,6-dioxaspiro[4.5]decan-9-amine
CID 79897668
N-[2-(1,4-oxazepan-4-yl)ethyl]cyclopropanamine
CID 62987458
N-(2-morpholin-4-ylethyl)piperidin-4-amine
CID 61016051
N-(2-piperidin-1-ylethyl)oxepan-4-amine
CID 65081716
4,4-dimethyl-N-(2-morpholin-4-ylethyl)cycloheptan-1-amine
CID 65082758
3-(oxan-4-ylamino)propane-1-thiol
CID 115224666
N-(3-imidazol-1-ylpropyl)oxan-4-amine
CID 43608608
3-methyl-N-(2-morpholin-4-ylethyl)cyclopentan-1-amine
CID 23767314

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)oxan-4-amine?
The IUPAC name of N-(3-morpholin-4-ylpropyl)oxan-4-amine (CID 18349139) is N-(3-morpholin-4-ylpropyl)oxan-4-amine.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)oxan-4-amine?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)oxan-4-amine is C(CNC1CCOCC1)CN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)oxan-4-amine?
The InChIKey is RIFGLNPGHOKYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1(5-14-6-10-16-11-7-14)4-13-12-2-8-15-9-3-12/h12-13H,1-11H2.
What are the key properties of N-(3-morpholin-4-ylpropyl)oxan-4-amine?
N-(3-morpholin-4-ylpropyl)oxan-4-amine has a molecular weight of 228.34 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)oxan-4-amine is sourced from PubChem (CID 18349139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).