N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine

C17H29N3O — CID 115939344

IUPACN-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine
SMILESCCNC(CC)c1ccc(N2CC(C)OCC2CC)cn1
InChIInChI=1S/C17H29N3O/c1-5-14-12-21-13(4)11-20(14)15-8-9-17(19-10-15)16(6-2)18-7-3/h8-10,13-14,16,18H,5-7,11-12H2,1-4H3
InChIKeyCKKAKPGAZAODME-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.15
Rot. Bonds6

About N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine

N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine (PubChem CID 115939344) has the molecular formula C17H29N3O and a molecular weight of 291.44 g/mol. Its IUPAC name is N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine
PubChem CID115939344
Molecular FormulaC17H29N3O
Molecular Weight291.44 g/mol
Exact Mass291.23
IUPAC NameN-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine
SMILESCCNC(CC)c1ccc(N2CC(C)OCC2CC)cn1
InChIInChI=1S/C17H29N3O/c1-5-14-12-21-13(4)11-20(14)15-8-9-17(19-10-15)16(6-2)18-7-3/h8-10,13-14,16,18H,5-7,11-12H2,1-4H3
InChIKeyCKKAKPGAZAODME-UHFFFAOYSA-N
XLogP3.15
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine?
The IUPAC name of N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine (CID 115939344) is N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine.
What is the SMILES notation for N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine?
The canonical SMILES for N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine is CCNC(CC)c1ccc(N2CC(C)OCC2CC)cn1.
What is the InChIKey of N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine?
The InChIKey is CKKAKPGAZAODME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N3O/c1-5-14-12-21-13(4)11-20(14)15-8-9-17(19-10-15)16(6-2)18-7-3/h8-10,13-14,16,18H,5-7,11-12H2,1-4H3.
What are the key properties of N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine?
N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine has a molecular weight of 291.44 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[5-(5-ethyl-2-methylmorpholin-4-yl)-2-pyridinyl]propan-1-amine is sourced from PubChem (CID 115939344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).