1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine

C13H24N4O — CID 79051030

IUPAC1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCCn1ccnc1C(N)C(C)(C)N1CCOCC1
InChIInChI=1S/C13H24N4O/c1-4-16-6-5-15-12(16)11(14)13(2,3)17-7-9-18-10-8-17/h5-6,11H,4,7-10,14H2,1-3H3
InChIKeyULEHLCCOIYGAOQ-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.01
Rot. Bonds4

About 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine

1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine (PubChem CID 79051030) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine
PubChem CID79051030
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine
SMILESCCn1ccnc1C(N)C(C)(C)N1CCOCC1
InChIInChI=1S/C13H24N4O/c1-4-16-6-5-15-12(16)11(14)13(2,3)17-7-9-18-10-8-17/h5-6,11H,4,7-10,14H2,1-3H3
InChIKeyULEHLCCOIYGAOQ-UHFFFAOYSA-N
XLogP1.01
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine (CID 79051030) is 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine is CCn1ccnc1C(N)C(C)(C)N1CCOCC1.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
The InChIKey is ULEHLCCOIYGAOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-4-16-6-5-15-12(16)11(14)13(2,3)17-7-9-18-10-8-17/h5-6,11H,4,7-10,14H2,1-3H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine?
1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine has a molecular weight of 252.36 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-2-methyl-2-morpholin-4-ylpropan-1-amine is sourced from PubChem (CID 79051030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).