5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide

C12H18N4O — CID 115489519

IUPAC5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCOC(CC)C2)cn1
InChIInChI=1S/C12H18N4O/c1-2-10-8-16(5-6-17-10)9-3-4-11(12(13)14)15-7-9/h3-4,7,10H,2,5-6,8H2,1H3,(H3,13,14)
InChIKeyANRAKERLMKVZIV-UHFFFAOYSA-N
MW234.30 g/mol
LogP0.98
Rot. Bonds3

About 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide

5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide (PubChem CID 115489519) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide.

Molecular Properties

Compound Name5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide
PubChem CID115489519
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1ccc(N2CCOC(CC)C2)cn1
InChIInChI=1S/C12H18N4O/c1-2-10-8-16(5-6-17-10)9-3-4-11(12(13)14)15-7-9/h3-4,7,10H,2,5-6,8H2,1H3,(H3,13,14)
InChIKeyANRAKERLMKVZIV-UHFFFAOYSA-N
XLogP0.98
TPSA75.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

5-morpholin-4-ylpyridine-2-carboximidamide
CID 115489462
5-[4-(1-hydroxyethyl)piperidin-1-yl]pyridine-2-carboximidamide
CID 106836148
5-(3,3-diethylpyrrolidin-1-yl)pyridine-2-carboximidamide
CID 115489708
5-(4-hydroxy-4-methylpiperidin-1-yl)pyridine-2-carboximidamide
CID 113321263
4-(2-ethylmorpholin-4-yl)-3-fluorobenzenecarboximidamide
CID 43658320
5-(8-azaspiro[4.5]decan-8-yl)pyridine-2-carboximidamide
CID 115489654
5-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]pyridine-2-carboximidamide
CID 115489641
6-(2-ethylmorpholin-4-yl)pyridine-3-carbothioamide
CID 43562927
(1R)-1-[5-(2-ethyl-1,4-oxazepan-4-yl)-2-pyridinyl]ethanamine
CID 114218474
4-[2-(hydroxymethyl)morpholin-4-yl]-2-(trifluoromethyl)benzenecarboximidamide
CID 81195077
2-(2-ethylmorpholin-4-yl)pyrimidin-5-amine
CID 61147387
5-(2-ethylmorpholin-4-yl)sulfonylpyridine-2-carbothioamide
CID 114614163

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide?
The IUPAC name of 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide (CID 115489519) is 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide.
What is the SMILES notation for 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide?
The canonical SMILES for 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide is [H]/N=C(\N)c1ccc(N2CCOC(CC)C2)cn1.
What is the InChIKey of 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide?
The InChIKey is ANRAKERLMKVZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-2-10-8-16(5-6-17-10)9-3-4-11(12(13)14)15-7-9/h3-4,7,10H,2,5-6,8H2,1H3,(H3,13,14).
What are the key properties of 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide?
5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide has a molecular weight of 234.30 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylmorpholin-4-yl)pyridine-2-carboximidamide is sourced from PubChem (CID 115489519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).