N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine

C15H23N3O — CID 62283293

IUPACN-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine
SMILESCCC1COCCN1c1ncccc1CNC1CC1
InChIInChI=1S/C15H23N3O/c1-2-14-11-19-9-8-18(14)15-12(4-3-7-16-15)10-17-13-5-6-13/h3-4,7,13-14,17H,2,5-6,8-11H2,1H3
InChIKeyNUNGEUIYMMETTL-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.95
Rot. Bonds5

About N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine

N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine (PubChem CID 62283293) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine
PubChem CID62283293
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine
SMILESCCC1COCCN1c1ncccc1CNC1CC1
InChIInChI=1S/C15H23N3O/c1-2-14-11-19-9-8-18(14)15-12(4-3-7-16-15)10-17-13-5-6-13/h3-4,7,13-14,17H,2,5-6,8-11H2,1H3
InChIKeyNUNGEUIYMMETTL-UHFFFAOYSA-N
XLogP1.95
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine (CID 62283293) is N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine is CCC1COCCN1c1ncccc1CNC1CC1.
What is the InChIKey of N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine?
The InChIKey is NUNGEUIYMMETTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-14-11-19-9-8-18(14)15-12(4-3-7-16-15)10-17-13-5-6-13/h3-4,7,13-14,17H,2,5-6,8-11H2,1H3.
What are the key properties of N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine?
N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine has a molecular weight of 261.37 g/mol, XLogP of 1.95, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(3-ethylmorpholin-4-yl)-3-pyridinyl]methyl]cyclopropanamine is sourced from PubChem (CID 62283293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).