4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide

C10H19N3O2 — CID 79680425

IUPAC4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide
SMILESNC(=NO)C1CN(CCC2CC2)CCO1
InChIInChI=1S/C10H19N3O2/c11-10(12-14)9-7-13(5-6-15-9)4-3-8-1-2-8/h8-9,14H,1-7H2,(H2,11,12)
InChIKeySKFUGEYJXLFMNK-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.23
Rot. Bonds4

About 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide

4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide (PubChem CID 79680425) has the molecular formula C10H19N3O2 and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide.

Molecular Properties

Compound Name4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide
PubChem CID79680425
Molecular FormulaC10H19N3O2
Molecular Weight213.28 g/mol
Exact Mass213.15
IUPAC Name4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide
SMILESNC(=NO)C1CN(CCC2CC2)CCO1
InChIInChI=1S/C10H19N3O2/c11-10(12-14)9-7-13(5-6-15-9)4-3-8-1-2-8/h8-9,14H,1-7H2,(H2,11,12)
InChIKeySKFUGEYJXLFMNK-UHFFFAOYSA-N
XLogP0.23
TPSA71.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.23
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'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide?
The IUPAC name of 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide (CID 79680425) is 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide.
What is the SMILES notation for 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide?
The canonical SMILES for 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide is NC(=NO)C1CN(CCC2CC2)CCO1.
What is the InChIKey of 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide?
The InChIKey is SKFUGEYJXLFMNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O2/c11-10(12-14)9-7-13(5-6-15-9)4-3-8-1-2-8/h8-9,14H,1-7H2,(H2,11,12).
What are the key properties of 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide?
4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide has a molecular weight of 213.28 g/mol, XLogP of 0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-cyclopropylethyl)-N'-hydroxymorpholine-2-carboximidamide is sourced from PubChem (CID 79680425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).