4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide

C9H18N4O3 — CID 83105404

IUPAC4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1C(C)C(=O)NN
InChIInChI=1S/C9H18N4O3/c1-6(8(14)12-10)13-3-4-16-5-7(13)9(15)11-2/h6-7H,3-5,10H2,1-2H3,(H,11,15)(H,12,14)
InChIKeyPHDRDMSXVKLXOO-UHFFFAOYSA-N
MW230.27 g/mol
LogP-2.19
Rot. Bonds3

About 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide

4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide (PubChem CID 83105404) has the molecular formula C9H18N4O3 and a molecular weight of 230.27 g/mol. Its IUPAC name is 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide.

Molecular Properties

Compound Name4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide
PubChem CID83105404
Molecular FormulaC9H18N4O3
Molecular Weight230.27 g/mol
Exact Mass230.14
IUPAC Name4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide
SMILESCNC(=O)C1COCCN1C(C)C(=O)NN
InChIInChI=1S/C9H18N4O3/c1-6(8(14)12-10)13-3-4-16-5-7(13)9(15)11-2/h6-7H,3-5,10H2,1-2H3,(H,11,15)(H,12,14)
InChIKeyPHDRDMSXVKLXOO-UHFFFAOYSA-N
XLogP-2.19
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 5-2.19
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

2-(3-methylmorpholin-4-yl)propanehydrazide
CID 63573861
4-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105075
4-(4-amino-4-sulfanylidenebutan-2-yl)-N-methylmorpholine-3-carboxamide
CID 83099710
4-(1-hydrazinyl-3-methyl-1-oxobutan-2-yl)morpholine-3-carboxamide
CID 83095756
4-(1-aminopentan-3-yl)-N-methylmorpholine-3-carboxamide
CID 83106233
methyl 4-[1-(carbamoylamino)-1-oxopropan-2-yl]morpholine-3-carboxylate
CID 104775016
4-(3-amino-1,1,1-trifluoropentan-2-yl)-N-methylmorpholine-3-carboxamide
CID 83107069
(3S)-N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 140959044
N,4-di(propan-2-yl)morpholine-3-carboxamide
CID 118118161
2-(6-hydroxy-1,4-oxazepan-4-yl)propanehydrazide
CID 131000958
4-[2-amino-1-(5-bromothiophen-2-yl)propyl]-N-methylmorpholine-3-carboxamide
CID 83106857
4-(5-hydrazinyl-5-oxopentan-2-yl)-N-propan-2-ylmorpholine-3-carboxamide
CID 83105965

Frequently Asked Questions

What is the IUPAC name of 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide?
The IUPAC name of 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide (CID 83105404) is 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide.
What is the SMILES notation for 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide?
The canonical SMILES for 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide is CNC(=O)C1COCCN1C(C)C(=O)NN.
What is the InChIKey of 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide?
The InChIKey is PHDRDMSXVKLXOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N4O3/c1-6(8(14)12-10)13-3-4-16-5-7(13)9(15)11-2/h6-7H,3-5,10H2,1-2H3,(H,11,15)(H,12,14).
What are the key properties of 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide?
4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide has a molecular weight of 230.27 g/mol, XLogP of -2.19, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-hydrazinyl-1-oxopropan-2-yl)-N-methylmorpholine-3-carboxamide is sourced from PubChem (CID 83105404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).