1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine

C13H26N2O2 — CID 55242797

IUPAC1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine
SMILESCC(CN1CCOCC1)NCC1CCCOC1
InChIInChI=1S/C13H26N2O2/c1-12(10-15-4-7-16-8-5-15)14-9-13-3-2-6-17-11-13/h12-14H,2-11H2,1H3
InChIKeyKFCQFWIJCUTRAP-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.72
Rot. Bonds5

About 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine

1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine (PubChem CID 55242797) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine
PubChem CID55242797
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine
SMILESCC(CN1CCOCC1)NCC1CCCOC1
InChIInChI=1S/C13H26N2O2/c1-12(10-15-4-7-16-8-5-15)14-9-13-3-2-6-17-11-13/h12-14H,2-11H2,1H3
InChIKeyKFCQFWIJCUTRAP-UHFFFAOYSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
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

4-methyl-N-(oxan-3-ylmethyl)pentan-2-amine
CID 61020127
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4,4,4-trifluoro-N-(oxan-3-ylmethyl)butan-2-amine
CID 103778206
N-[(5-methyloxolan-2-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 82834990
1-morpholin-4-yl-2-(oxan-3-ylmethylamino)propan-1-one
CID 54905983
N-(cyclohexylmethyl)-1-pyrrolidin-1-ylpropan-2-amine
CID 61223586
N-(oxan-3-ylmethyl)-1-(oxolan-3-yl)ethanamine
CID 115710912
1-(1,4-oxazepan-4-yl)-N-propylpropan-2-amine
CID 62988157
N'-hydroxy-3-(oxan-3-ylmethylamino)butanimidamide
CID 77031801
N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine
CID 62591322
1-(1-methylcyclopropyl)-N-(oxan-3-ylmethyl)ethanamine
CID 61020377
2-methyl-3-(oxan-3-ylmethylamino)butan-1-ol
CID 115907690

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine?
The IUPAC name of 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine (CID 55242797) is 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine?
The canonical SMILES for 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine is CC(CN1CCOCC1)NCC1CCCOC1.
What is the InChIKey of 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine?
The InChIKey is KFCQFWIJCUTRAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-12(10-15-4-7-16-8-5-15)14-9-13-3-2-6-17-11-13/h12-14H,2-11H2,1H3.
What are the key properties of 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine?
1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine has a molecular weight of 242.36 g/mol, XLogP of 0.72, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-N-(oxan-3-ylmethyl)propan-2-amine is sourced from PubChem (CID 55242797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).