2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide

C11H13N5O — CID 116801525

IUPAC2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1ccnc(Oc2cnn(CC)c2)c1
InChIInChI=1S/C11H13N5O/c1-2-16-7-9(6-15-16)17-10-5-8(11(12)13)3-4-14-10/h3-7H,2H2,1H3,(H3,12,13)
InChIKeyGVIMRXKWQSKEAI-UHFFFAOYSA-N
MW231.26 g/mol
LogP1.37
Rot. Bonds4

About 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide

2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide (PubChem CID 116801525) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide.

Molecular Properties

Compound Name2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide
PubChem CID116801525
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC Name2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide
SMILES[H]/N=C(\N)c1ccnc(Oc2cnn(CC)c2)c1
InChIInChI=1S/C11H13N5O/c1-2-16-7-9(6-15-16)17-10-5-8(11(12)13)3-4-14-10/h3-7H,2H2,1H3,(H3,12,13)
InChIKeyGVIMRXKWQSKEAI-UHFFFAOYSA-N
XLogP1.37
TPSA89.81 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

2-[(5-chloro-3-pyridinyl)oxy]pyridine-4-carboximidamide
CID 64602153
4-(1-ethylpyrazol-4-yl)oxyquinoline-3-carboximidamide
CID 116801498
5-bromo-2-(1-ethylpyrazol-4-yl)oxybenzenecarboximidamide
CID 114893388
2-[4-(trifluoromethyl)phenoxy]pyridine-4-carboximidamide
CID 43150625
N-[[2-(1-ethylpyrazol-4-yl)oxy-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 116802810
3-[(4-ethoxypyrazol-1-yl)methyl]benzenecarboximidamide
CID 114274034
2-(1-propylpyrazol-4-yl)oxypyridin-4-amine
CID 116800439
2-(2,6-dimethylphenoxy)pyridine-4-carboximidamide
CID 24710757
4-(1-ethylpyrazol-4-yl)oxypyridine-2-carbothioamide
CID 116801295
2-[(2-ethyl-6-methyl-3-pyridinyl)oxy]pyridine-4-carboximidamide
CID 103174853
4-(1-ethylpyrazol-4-yl)oxypyridin-2-amine
CID 116805835
2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)pyridine-4-carboximidamide
CID 61398835

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide?
The IUPAC name of 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide (CID 116801525) is 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide.
What is the SMILES notation for 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide?
The canonical SMILES for 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide is [H]/N=C(\N)c1ccnc(Oc2cnn(CC)c2)c1.
What is the InChIKey of 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide?
The InChIKey is GVIMRXKWQSKEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c1-2-16-7-9(6-15-16)17-10-5-8(11(12)13)3-4-14-10/h3-7H,2H2,1H3,(H3,12,13).
What are the key properties of 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide?
2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide has a molecular weight of 231.26 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrazol-4-yl)oxypyridine-4-carboximidamide is sourced from PubChem (CID 116801525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).