(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide

C9H17N3O3 — CID 134235288

IUPAC(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide
SMILESC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)NN
InChIInChI=1S/C9H17N3O3/c1-5(8(14)12-10)11-9(15)7(13)6-3-2-4-6/h5-7,13H,2-4,10H2,1H3,(H,11,15)(H,12,14)/t5-,7-/m0/s1
InChIKeyMQLMNKUYTOHYCF-FSPLSTOPSA-N
MW215.25 g/mol
LogP-1.36
Rot. Bonds4

About (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide

(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide (PubChem CID 134235288) has the molecular formula C9H17N3O3 and a molecular weight of 215.25 g/mol. Its IUPAC name is (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide.

Molecular Properties

Compound Name(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide
PubChem CID134235288
Molecular FormulaC9H17N3O3
Molecular Weight215.25 g/mol
Exact Mass215.13
IUPAC Name(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide
SMILESC[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)NN
InChIInChI=1S/C9H17N3O3/c1-5(8(14)12-10)11-9(15)7(13)6-3-2-4-6/h5-7,13H,2-4,10H2,1H3,(H,11,15)(H,12,14)/t5-,7-/m0/s1
InChIKeyMQLMNKUYTOHYCF-FSPLSTOPSA-N
XLogP-1.36
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 5-1.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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-cyclopentyl-N-(1-hydrazinyl-1-oxopropan-2-yl)propanamide;ethane;morpholine
CID 166116113
[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid
CID 90311881
2-cyclobutyl-2-hydroxyacetamide
CID 69459333
(3S)-3-amino-4-[[(2R)-1-[[cyclobutyl(cyclopentyl)methyl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid
CID 54502913
N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide
CID 10464584
(2S)-2-cyclopropyl-N-[(2S)-3,3-dimethylbutan-2-yl]-2-hydroxyacetamide
CID 172508642
N-[1-(cyclopropylamino)-1-oxopropan-2-yl]-2-methylpropanamide
CID 115599512
methyl 2-cyclododecyl-2-hydroxyacetate
CID 66287971
2-cyano-2-(3-methylcyclohexyl)acetohydrazide
CID 130714844
(2S)-2-cyclobutyl-2-hydroxyacetic acid
CID 118175739
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 7090487
(2S)-N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[[(2S)-2-cyclohexyl-2-hydroxyacetyl]amino]propanamide
CID 142992313

Frequently Asked Questions

What is the IUPAC name of (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide?
The IUPAC name of (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide (CID 134235288) is (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide.
What is the SMILES notation for (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide?
The canonical SMILES for (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide is C[C@H](NC(=O)[C@@H](O)C1CCC1)C(=O)NN.
What is the InChIKey of (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide?
The InChIKey is MQLMNKUYTOHYCF-FSPLSTOPSA-N. The full InChI is InChI=1S/C9H17N3O3/c1-5(8(14)12-10)11-9(15)7(13)6-3-2-4-6/h5-7,13H,2-4,10H2,1H3,(H,11,15)(H,12,14)/t5-,7-/m0/s1.
What are the key properties of (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide?
(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide has a molecular weight of 215.25 g/mol, XLogP of -1.36, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide is sourced from PubChem (CID 134235288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).