(3R)-5-hydrazinyl-3-methyl-5-oxopentanamide

C6H13N3O2 — CID 173105688

IUPAC(3R)-5-hydrazinyl-3-methyl-5-oxopentanamide
SMILESC[C@H](CC(N)=O)CC(=O)NN
InChIInChI=1S/C6H13N3O2/c1-4(2-5(7)10)3-6(11)9-8/h4H,2-3,8H2,1H3,(H2,7,10)(H,9,11)/t4-/m1/s1
InChIKeyCYBUHHILLZJVQW-SCSAIBSYSA-N
MW159.19 g/mol
LogP-1.12
Rot. Bonds4

About (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide

(3R)-5-hydrazinyl-3-methyl-5-oxopentanamide (PubChem CID 173105688) has the molecular formula C6H13N3O2 and a molecular weight of 159.19 g/mol. Its IUPAC name is (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide.

Molecular Properties

Compound Name(3R)-5-hydrazinyl-3-methyl-5-oxopentanamide
PubChem CID173105688
Molecular FormulaC6H13N3O2
Molecular Weight159.19 g/mol
Exact Mass159.10
IUPAC Name(3R)-5-hydrazinyl-3-methyl-5-oxopentanamide
SMILESC[C@H](CC(N)=O)CC(=O)NN
InChIInChI=1S/C6H13N3O2/c1-4(2-5(7)10)3-6(11)9-8/h4H,2-3,8H2,1H3,(H2,7,10)(H,9,11)/t4-/m1/s1
InChIKeyCYBUHHILLZJVQW-SCSAIBSYSA-N
XLogP-1.12
TPSA98.21 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 5-1.12
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

(3R)-N'-methoxy-3-methylpentanediamide
CID 173105734
3-methylhexanedihydrazide
CID 141312622
3,5,5-trimethylhexanehydrazide
CID 142619235
(3R)-5-amino-3-methyl-5-oxopentanoic acid
CID 55285544
3-phosphanylbutanehydrazide
CID 163485274
(3R)-5-amino-3-methyl-5-sulfanylidenepentanamide
CID 173060911
3-(4-hydrazinyl-4-oxobutan-2-yl)oxybutanehydrazide
CID 87665575
ethane;4-hydroxy-3-methylbutanamide
CID 170602711
5-[(2-amino-2-oxoethyl)amino]-3-methyl-5-oxopentanoic acid
CID 62966422
3-methylbutanamide
CID 87933309
3,3-difluoropropanehydrazide
CID 162600392
3-[[amino(hydrazinyl)methylidene]amino]butanamide
CID 104870450

Frequently Asked Questions

What is the IUPAC name of (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide?
The IUPAC name of (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide (CID 173105688) is (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide.
What is the SMILES notation for (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide?
The canonical SMILES for (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide is C[C@H](CC(N)=O)CC(=O)NN.
What is the InChIKey of (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide?
The InChIKey is CYBUHHILLZJVQW-SCSAIBSYSA-N. The full InChI is InChI=1S/C6H13N3O2/c1-4(2-5(7)10)3-6(11)9-8/h4H,2-3,8H2,1H3,(H2,7,10)(H,9,11)/t4-/m1/s1.
What are the key properties of (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide?
(3R)-5-hydrazinyl-3-methyl-5-oxopentanamide has a molecular weight of 159.19 g/mol, XLogP of -1.12, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-5-hydrazinyl-3-methyl-5-oxopentanamide is sourced from PubChem (CID 173105688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).