N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine

C15H30N2O2 — CID 62257157

IUPACN-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine
SMILESCCCNCC1(CN2CC(C)OCC2C)CCOC1
InChIInChI=1S/C15H30N2O2/c1-4-6-16-10-15(5-7-18-12-15)11-17-8-14(3)19-9-13(17)2/h13-14,16H,4-12H2,1-3H3
InChIKeyYHVIJRBNKHFTLC-UHFFFAOYSA-N
MW270.42 g/mol
LogP1.50
Rot. Bonds6

About N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine

N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine (PubChem CID 62257157) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine.

Molecular Properties

Compound NameN-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine
PubChem CID62257157
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine
SMILESCCCNCC1(CN2CC(C)OCC2C)CCOC1
InChIInChI=1S/C15H30N2O2/c1-4-6-16-10-15(5-7-18-12-15)11-17-8-14(3)19-9-13(17)2/h13-14,16H,4-12H2,1-3H3
InChIKeyYHVIJRBNKHFTLC-UHFFFAOYSA-N
XLogP1.50
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.50
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-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxan-3-yl]methyl]ethanamine
CID 55243401
1-[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxan-3-yl]-N-methylmethanamine
CID 63739595
N-[[3-[(5-ethyl-2-methylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]-2-methylpropan-1-amine
CID 62258812
N-[[1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclopentyl]methyl]ethanamine
CID 62257854
N-[[4-[(2,5-dimethylmorpholin-4-yl)methyl]oxan-4-yl]methyl]cyclopropanamine
CID 62391481
N-[[3-(morpholin-4-ylmethyl)oxolan-3-yl]methyl]propan-1-amine
CID 62263535
N-[[3-[(2-methylpiperidin-1-yl)methyl]oxan-3-yl]methyl]propan-1-amine
CID 63741518
N-[[4-[(2-methylpyrrolidin-1-yl)methyl]oxan-4-yl]methyl]propan-1-amine
CID 55066618
N-[[4-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]oxan-4-yl]methyl]propan-1-amine
CID 104960649
4-methyl-1-[[3-(propylaminomethyl)oxolan-3-yl]methyl]piperidin-4-ol
CID 81115170
N-[[3-[(2,2,6-trimethylmorpholin-4-yl)methyl]oxan-3-yl]methyl]propan-1-amine
CID 63739810
N-[[1-[(2,5-dimethylmorpholin-4-yl)methyl]cyclopentyl]methyl]-2-methylpropan-2-amine
CID 62258028

Frequently Asked Questions

What is the IUPAC name of N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine?
The IUPAC name of N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine (CID 62257157) is N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine.
What is the SMILES notation for N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine?
The canonical SMILES for N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine is CCCNCC1(CN2CC(C)OCC2C)CCOC1.
What is the InChIKey of N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine?
The InChIKey is YHVIJRBNKHFTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-4-6-16-10-15(5-7-18-12-15)11-17-8-14(3)19-9-13(17)2/h13-14,16H,4-12H2,1-3H3.
What are the key properties of N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine?
N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine has a molecular weight of 270.42 g/mol, XLogP of 1.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(2,5-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-1-amine is sourced from PubChem (CID 62257157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).