N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine

C14H28N2O2 — CID 63740811

IUPACN-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine
SMILESCC(C)NCC1(CN2CCOCC2)CCCOC1
InChIInChI=1S/C14H28N2O2/c1-13(2)15-10-14(4-3-7-18-12-14)11-16-5-8-17-9-6-16/h13,15H,3-12H2,1-2H3
InChIKeyUMQFFYVTDYJEMJ-UHFFFAOYSA-N
MW256.39 g/mol
LogP1.11
Rot. Bonds5

About N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine

N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine (PubChem CID 63740811) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine
PubChem CID63740811
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine
SMILESCC(C)NCC1(CN2CCOCC2)CCCOC1
InChIInChI=1S/C14H28N2O2/c1-13(2)15-10-14(4-3-7-18-12-14)11-16-5-8-17-9-6-16/h13,15H,3-12H2,1-2H3
InChIKeyUMQFFYVTDYJEMJ-UHFFFAOYSA-N
XLogP1.11
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[3-(azocan-1-ylmethyl)oxan-3-yl]methyl]propan-2-amine
CID 63740115
N-[[3-[(4-ethylpiperazin-1-yl)methyl]oxan-3-yl]methyl]propan-2-amine
CID 63742224
2-methyl-N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-1-amine
CID 55243009
N-[[3-[(3,3-dimethylmorpholin-4-yl)methyl]oxan-3-yl]methyl]propan-2-amine
CID 63740510
N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]ethanamine
CID 63740455
N-[[3-[(2-ethylmorpholin-4-yl)methyl]oxan-3-yl]methyl]propan-2-amine
CID 63740129
N-[[3-[(3-methylmorpholin-4-yl)methyl]oxan-3-yl]methyl]propan-2-amine
CID 55243400
N-[[3-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-ylmethyl)oxan-3-yl]methyl]propan-2-amine
CID 79934366
3-methyl-1-[[3-[(propan-2-ylamino)methyl]oxan-3-yl]methyl]piperidin-4-ol
CID 114682063
N-[[3-[(2,2-dimethylmorpholin-4-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 62258067
N-[[3-[(4-methylazepan-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 55249798
N-[[3-[(4-propylpiperidin-1-yl)methyl]oxolan-3-yl]methyl]propan-2-amine
CID 62258098

Frequently Asked Questions

What is the IUPAC name of N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine?
The IUPAC name of N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine (CID 63740811) is N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine is CC(C)NCC1(CN2CCOCC2)CCCOC1.
What is the InChIKey of N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine?
The InChIKey is UMQFFYVTDYJEMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-13(2)15-10-14(4-3-7-18-12-14)11-16-5-8-17-9-6-16/h13,15H,3-12H2,1-2H3.
What are the key properties of N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine?
N-[[3-(morpholin-4-ylmethyl)oxan-3-yl]methyl]propan-2-amine has a molecular weight of 256.39 g/mol, XLogP of 1.11, 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-ylmethyl)oxan-3-yl]methyl]propan-2-amine is sourced from PubChem (CID 63740811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).