1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide

C11H18N6O — CID 80917008

IUPAC1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide
SMILESCc1nc(NN)cc(N2CCC(C(N)=O)CC2)n1
InChIInChI=1S/C11H18N6O/c1-7-14-9(16-13)6-10(15-7)17-4-2-8(3-5-17)11(12)18/h6,8H,2-5,13H2,1H3,(H2,12,18)(H,14,15,16)
InChIKeyDMCDYEPBWIAURO-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.23
Rot. Bonds3

About 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide

1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide (PubChem CID 80917008) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide
PubChem CID80917008
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC Name1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide
SMILESCc1nc(NN)cc(N2CCC(C(N)=O)CC2)n1
InChIInChI=1S/C11H18N6O/c1-7-14-9(16-13)6-10(15-7)17-4-2-8(3-5-17)11(12)18/h6,8H,2-5,13H2,1H3,(H2,12,18)(H,14,15,16)
InChIKeyDMCDYEPBWIAURO-UHFFFAOYSA-N
XLogP-0.23
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-(2-hydrazinyl-6-methylpyrimidin-4-yl)piperidine-4-carboxamide
CID 80917080
1-(6-hydrazinyl-2-methylpyrimidin-4-yl)pyrrolidin-3-ol
CID 80919413
1-[2-cyclopropyl-6-(methylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80957124
[6-[4-(methoxymethyl)piperidin-1-yl]-2-methylpyrimidin-4-yl]hydrazine
CID 80911487
[6-(1,1-dioxo-1,4-thiazinan-4-yl)-2-methylpyrimidin-4-yl]hydrazine
CID 13393629
1-[2-cyclopropyl-6-(ethylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80956690
1-(6-methyl-2-pyridinyl)piperidine-4-carboxamide
CID 133313226
N-[1-(2-amino-6-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide
CID 113402704
ethyl 1-(6-ethoxy-2-methylpyrimidin-4-yl)piperidine-4-carboxylate
CID 66334132
1-[6-(2,4-dimethylanilino)-2-methylpyrimidin-4-yl]piperidine-4-carboxylic acid
CID 113193605
1-[6-(4-methoxyanilino)-2-methylpyrimidin-4-yl]piperidine-4-carboxylic acid
CID 99975814
1-(2-cyclopropyl-6-oxo-1H-pyrimidin-4-yl)piperidine-4-carboxamide
CID 137008934

Frequently Asked Questions

What is the IUPAC name of 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide (CID 80917008) is 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide is Cc1nc(NN)cc(N2CCC(C(N)=O)CC2)n1.
What is the InChIKey of 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide?
The InChIKey is DMCDYEPBWIAURO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c1-7-14-9(16-13)6-10(15-7)17-4-2-8(3-5-17)11(12)18/h6,8H,2-5,13H2,1H3,(H2,12,18)(H,14,15,16).
What are the key properties of 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide?
1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide has a molecular weight of 250.31 g/mol, XLogP of -0.23, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-hydrazinyl-2-methylpyrimidin-4-yl)piperidine-4-carboxamide is sourced from PubChem (CID 80917008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).