N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide

C12H24N4O3 — CID 83104052

IUPACN-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1CC(C)(C)C(=O)NN
InChIInChI=1S/C12H24N4O3/c1-4-14-10(17)9-7-19-6-5-16(9)8-12(2,3)11(18)15-13/h9H,4-8,13H2,1-3H3,(H,14,17)(H,15,18)
InChIKeyACXPQELEIACHSR-UHFFFAOYSA-N
MW272.35 g/mol
LogP-1.16
Rot. Bonds5

About N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide

N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide (PubChem CID 83104052) has the molecular formula C12H24N4O3 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide
PubChem CID83104052
Molecular FormulaC12H24N4O3
Molecular Weight272.35 g/mol
Exact Mass272.18
IUPAC NameN-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide
SMILESCCNC(=O)C1COCCN1CC(C)(C)C(=O)NN
InChIInChI=1S/C12H24N4O3/c1-4-14-10(17)9-7-19-6-5-16(9)8-12(2,3)11(18)15-13/h9H,4-8,13H2,1-3H3,(H,14,17)(H,15,18)
InChIKeyACXPQELEIACHSR-UHFFFAOYSA-N
XLogP-1.16
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 5-1.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylmorpholine-3-carboxamide
CID 83105959
N-ethyl-4-(3-hydrazinyl-3-oxopropyl)morpholine-3-carboxamide
CID 83104053
N-ethyl-4-(2-oxopropyl)morpholine-3-carboxamide
CID 83103810
4-(3-amino-3-oxopropyl)-N-ethylmorpholine-3-carboxamide
CID 83103716
hydrazinyl 3-[3-(ethylcarbamoyl)morpholin-4-yl]propanoate
CID 83105070
4-(3-amino-2-methylpropyl)-N-ethylmorpholine-3-carboxamide
CID 83106373
4-(5-amino-5-sulfanylidenepentyl)-N-ethylmorpholine-3-carboxamide
CID 83099476
4-(4-amino-2,2-dimethylpentan-3-yl)-N-ethylmorpholine-3-carboxamide
CID 83106921
3-N-ethylmorpholine-3,4-dicarboxamide
CID 83106248
6-[3-(ethylcarbamoyl)morpholin-4-yl]hexanoic acid
CID 83100363
4-[3-(ethylcarbamoyl)morpholin-4-yl]-3-hydroxybutanoic acid
CID 83100116
ethyl 2-[2-[3-(ethylcarbamoyl)morpholin-4-yl]ethoxy]acetate
CID 83100533

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide?
The IUPAC name of N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide (CID 83104052) is N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide.
What is the SMILES notation for N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide?
The canonical SMILES for N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide is CCNC(=O)C1COCCN1CC(C)(C)C(=O)NN.
What is the InChIKey of N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide?
The InChIKey is ACXPQELEIACHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O3/c1-4-14-10(17)9-7-19-6-5-16(9)8-12(2,3)11(18)15-13/h9H,4-8,13H2,1-3H3,(H,14,17)(H,15,18).
What are the key properties of N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide?
N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide has a molecular weight of 272.35 g/mol, XLogP of -1.16, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)morpholine-3-carboxamide is sourced from PubChem (CID 83104052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).