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

C6H13N3O2 — CID 10464584

IUPACN-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide
SMILESCCC(=O)N[C@@H](C)C(=O)NN
InChIInChI=1S/C6H13N3O2/c1-3-5(10)8-4(2)6(11)9-7/h4H,3,7H2,1-2H3,(H,8,10)(H,9,11)/t4-/m0/s1
InChIKeyKTNAORZEQZDYHJ-BYPYZUCNSA-N
MW159.19 g/mol
LogP-1.11
Rot. Bonds3

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

N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide (PubChem CID 10464584) has the molecular formula C6H13N3O2 and a molecular weight of 159.19 g/mol. Its IUPAC name is N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide.

Molecular Properties

Compound NameN-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide
PubChem CID10464584
Molecular FormulaC6H13N3O2
Molecular Weight159.19 g/mol
Exact Mass159.10
IUPAC NameN-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide
SMILESCCC(=O)N[C@@H](C)C(=O)NN
InChIInChI=1S/C6H13N3O2/c1-3-5(10)8-4(2)6(11)9-7/h4H,3,7H2,1-2H3,(H,8,10)(H,9,11)/t4-/m0/s1
InChIKeyKTNAORZEQZDYHJ-BYPYZUCNSA-N
XLogP-1.11
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 5-1.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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-(propanoylamino)-N-[[2-(propanoylamino)propanoylamino]methyl]propanamide
CID 18739938
[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid
CID 90311881
(2S)-N-(2-amino-2-oxoethyl)-2-(propanoylamino)propanamide
CID 138691369
N-(3-oxobutan-2-yl)propanamide
CID 22943760
N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-(4-methoxyphenyl)acetamide
CID 39819173
propanehydrazide;dihydrochloride
CID 121342206
ethane;propanehydrazide
CID 143310399
(5S)-4-oxo-5-(propanoylamino)hexanamide
CID 126731889
N-propan-2-ylpropanamide;dihydrochloride
CID 172679019
azane;propanehydrazide;hydroiodide
CID 174716911
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]-2-(2-methylphenoxy)acetamide
CID 51673879
(2R)-N-[2-(3,3-dimethylbutan-2-ylamino)-2-oxoethyl]-2-(propanoylamino)propanamide
CID 142118598

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide?
The IUPAC name of N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide (CID 10464584) is N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide.
What is the SMILES notation for N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide?
The canonical SMILES for N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide is CCC(=O)N[C@@H](C)C(=O)NN.
What is the InChIKey of N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide?
The InChIKey is KTNAORZEQZDYHJ-BYPYZUCNSA-N. The full InChI is InChI=1S/C6H13N3O2/c1-3-5(10)8-4(2)6(11)9-7/h4H,3,7H2,1-2H3,(H,8,10)(H,9,11)/t4-/m0/s1.
What are the key properties of N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide?
N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide has a molecular weight of 159.19 g/mol, XLogP of -1.11, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide is sourced from PubChem (CID 10464584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).