3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide

C11H24N4O2 — CID 54993082

IUPAC3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide
SMILESCCN(CC/C(N)=N/O)CCN1CCOCC1
InChIInChI=1S/C11H24N4O2/c1-2-14(4-3-11(12)13-16)5-6-15-7-9-17-10-8-15/h16H,2-10H2,1H3,(H2,12,13)
InChIKeyPWASJKYKPKVAQR-UHFFFAOYSA-N
MW244.34 g/mol
LogP-0.22
Rot. Bonds7

About 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide

3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide (PubChem CID 54993082) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide.

Molecular Properties

Compound Name3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide
PubChem CID54993082
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC Name3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide
SMILESCCN(CC/C(N)=N/O)CCN1CCOCC1
InChIInChI=1S/C11H24N4O2/c1-2-14(4-3-11(12)13-16)5-6-15-7-9-17-10-8-15/h16H,2-10H2,1H3,(H2,12,13)
InChIKeyPWASJKYKPKVAQR-UHFFFAOYSA-N
XLogP-0.22
TPSA74.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-0.22
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'}, {'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 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide?
The IUPAC name of 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide (CID 54993082) is 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide.
What is the SMILES notation for 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide?
The canonical SMILES for 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide is CCN(CC/C(N)=N/O)CCN1CCOCC1.
What is the InChIKey of 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide?
The InChIKey is PWASJKYKPKVAQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-2-14(4-3-11(12)13-16)5-6-15-7-9-17-10-8-15/h16H,2-10H2,1H3,(H2,12,13).
What are the key properties of 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide?
3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide has a molecular weight of 244.34 g/mol, XLogP of -0.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(2-morpholin-4-ylethyl)amino]-N'-hydroxypropanimidamide is sourced from PubChem (CID 54993082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).