(2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one

C5H10N4O — CID 816939

IUPAC(2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one
SMILESCC1=CC(=O)N[C@@H](NN)N1
InChIInChI=1S/C5H10N4O/c1-3-2-4(10)8-5(7-3)9-6/h2,5,7,9H,6H2,1H3,(H,8,10)/t5-/m0/s1
InChIKeyDJXHPRSNIXQISY-YFKPBYRVSA-N
MW142.16 g/mol
LogP-1.64
Rot. Bonds1

About (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one

(2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one (PubChem CID 816939) has the molecular formula C5H10N4O and a molecular weight of 142.16 g/mol. Its IUPAC name is (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one.

Molecular Properties

Compound Name(2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one
PubChem CID816939
Molecular FormulaC5H10N4O
Molecular Weight142.16 g/mol
Exact Mass142.09
IUPAC Name(2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one
SMILESCC1=CC(=O)N[C@@H](NN)N1
InChIInChI=1S/C5H10N4O/c1-3-2-4(10)8-5(7-3)9-6/h2,5,7,9H,6H2,1H3,(H,8,10)/t5-/m0/s1
InChIKeyDJXHPRSNIXQISY-YFKPBYRVSA-N
XLogP-1.64
TPSA79.18 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.16
LogP ≤ 5-1.64
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one?
The IUPAC name of (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one (CID 816939) is (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one.
What is the SMILES notation for (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one?
The canonical SMILES for (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one is CC1=CC(=O)N[C@@H](NN)N1.
What is the InChIKey of (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one?
The InChIKey is DJXHPRSNIXQISY-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H10N4O/c1-3-2-4(10)8-5(7-3)9-6/h2,5,7,9H,6H2,1H3,(H,8,10)/t5-/m0/s1.
What are the key properties of (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one?
(2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one has a molecular weight of 142.16 g/mol, XLogP of -1.64, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydrazinyl-6-methyl-2,3-dihydro-1H-pyrimidin-4-one is sourced from PubChem (CID 816939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).