3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine

C13H25N3O — CID 79182409

IUPAC3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine
SMILESCCN1CCOC(CN2CC(N)(C3CC3)C2)C1
InChIInChI=1S/C13H25N3O/c1-2-15-5-6-17-12(7-15)8-16-9-13(14,10-16)11-3-4-11/h11-12H,2-10,14H2,1H3
InChIKeyHYXHMEQIIACOCK-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.13
Rot. Bonds4

About 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine

3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine (PubChem CID 79182409) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine.

Molecular Properties

Compound Name3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine
PubChem CID79182409
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine
SMILESCCN1CCOC(CN2CC(N)(C3CC3)C2)C1
InChIInChI=1S/C13H25N3O/c1-2-15-5-6-17-12(7-15)8-16-9-13(14,10-16)11-3-4-11/h11-12H,2-10,14H2,1H3
InChIKeyHYXHMEQIIACOCK-UHFFFAOYSA-N
XLogP0.13
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-chloropyrrolidin-1-yl)methyl]-4-ethylmorpholine
CID 79182491
2-[4-[(4-ethylmorpholin-2-yl)methyl]piperazin-1-yl]ethanamine
CID 79165951
[1-[(4-ethylmorpholin-2-yl)methyl]-4-methylpiperidin-4-yl]methanamine
CID 107160487
3-ethyl-1-[(4-ethylmorpholin-2-yl)methyl]piperidin-4-amine
CID 81460895
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carboximidamide
CID 79171844
2,4-diethylmorpholine
CID 58988021
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carbothioamide
CID 79172211
1-[(4-ethylmorpholin-2-yl)methyl]piperidine-4-carbaldehyde
CID 79182828
4-ethyl-2-[[(3R)-3-methylpiperazin-1-yl]methyl]morpholine
CID 104975908
4-ethyl-2-[(3-ethyl-3-methyl-1,4-diazepan-1-yl)methyl]morpholine
CID 114401357
N-[[1-[(4-ethylmorpholin-2-yl)methyl]pyrrolidin-3-yl]methyl]propan-2-amine
CID 114400294
4-ethyl-2-propylmorpholine
CID 127673597

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine?
The IUPAC name of 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine (CID 79182409) is 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine.
What is the SMILES notation for 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine?
The canonical SMILES for 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine is CCN1CCOC(CN2CC(N)(C3CC3)C2)C1.
What is the InChIKey of 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine?
The InChIKey is HYXHMEQIIACOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-2-15-5-6-17-12(7-15)8-16-9-13(14,10-16)11-3-4-11/h11-12H,2-10,14H2,1H3.
What are the key properties of 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine?
3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine has a molecular weight of 239.36 g/mol, XLogP of 0.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-[(4-ethylmorpholin-2-yl)methyl]azetidin-3-amine is sourced from PubChem (CID 79182409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).