4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride

C11H25Cl2N3O2 — CID 119507639

IUPAC4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride
SMILESCCNCCNC(=O)C1CN(CC)CCO1.Cl.Cl
InChIInChI=1S/C11H23N3O2.2ClH/c1-3-12-5-6-13-11(15)10-9-14(4-2)7-8-16-10;;/h10,12H,3-9H2,1-2H3,(H,13,15);2*1H
InChIKeyIMVNNHCSZQHWBJ-UHFFFAOYSA-N
MW302.25 g/mol
LogP0.28
Rot. Bonds6

About 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride

4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride (PubChem CID 119507639) has the molecular formula C11H25Cl2N3O2 and a molecular weight of 302.25 g/mol. Its IUPAC name is 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride.

Molecular Properties

Compound Name4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride
PubChem CID119507639
Molecular FormulaC11H25Cl2N3O2
Molecular Weight302.25 g/mol
Exact Mass301.13
IUPAC Name4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride
SMILESCCNCCNC(=O)C1CN(CC)CCO1.Cl.Cl
InChIInChI=1S/C11H23N3O2.2ClH/c1-3-12-5-6-13-11(15)10-9-14(4-2)7-8-16-10;;/h10,12H,3-9H2,1-2H3,(H,13,15);2*1H
InChIKeyIMVNNHCSZQHWBJ-UHFFFAOYSA-N
XLogP0.28
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.25
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-ethyl-N-[2-(methylamino)ethyl]morpholine-2-carboxamide
CID 119502673
4-ethyl-N-[2-(4-hydroxyoxan-4-yl)ethyl]morpholine-2-carboxamide
CID 154743221
4-ethylmorpholine-2-carboxylate
CID 127053688
methyl 4-ethylmorpholine-2-carboxylate
CID 78926280
4-ethyl-N-(4-hydroxy-2,2-dimethylpentyl)morpholine-2-carboxamide
CID 71856712
N-(4-aminocyclohexyl)-4-ethylmorpholine-2-carboxamide;dihydrochloride
CID 119477299
N-(1-amino-4-methylpentan-2-yl)-4-ethylmorpholine-2-carboxamide
CID 119587494
4-ethyl-N-[2-(1-methylbenzimidazol-2-yl)ethyl]morpholine-2-carboxamide
CID 71984927
cycloheptyl-(4-ethylmorpholin-2-yl)methanone
CID 82931691
1-(4-ethylmorpholin-2-yl)-2-methylbutan-1-one
CID 79666840
N-(1-amino-2-cyclopropylpropan-2-yl)-4-ethylmorpholine-2-carboxamide
CID 119574545
N-[2-(ethylamino)ethyl]-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide;dihydrochloride
CID 119508727

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride?
The IUPAC name of 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride (CID 119507639) is 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride.
What is the SMILES notation for 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride?
The canonical SMILES for 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride is CCNCCNC(=O)C1CN(CC)CCO1.Cl.Cl.
What is the InChIKey of 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride?
The InChIKey is IMVNNHCSZQHWBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2.2ClH/c1-3-12-5-6-13-11(15)10-9-14(4-2)7-8-16-10;;/h10,12H,3-9H2,1-2H3,(H,13,15);2*1H.
What are the key properties of 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride?
4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride has a molecular weight of 302.25 g/mol, XLogP of 0.28, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(ethylamino)ethyl]morpholine-2-carboxamide;dihydrochloride is sourced from PubChem (CID 119507639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).