2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide

C11H18N6O — CID 80904290

IUPAC2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESNNc1nccc(N2CCC(CC(N)=O)CC2)n1
InChIInChI=1S/C11H18N6O/c12-9(18)7-8-2-5-17(6-3-8)10-1-4-14-11(15-10)16-13/h1,4,8H,2-3,5-7,13H2,(H2,12,18)(H,14,15,16)
InChIKeyBMXDQUKHIBAPJD-UHFFFAOYSA-N
MW250.31 g/mol
LogP-0.15
Rot. Bonds4

About 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide

2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide (PubChem CID 80904290) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide
PubChem CID80904290
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC Name2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide
SMILESNNc1nccc(N2CCC(CC(N)=O)CC2)n1
InChIInChI=1S/C11H18N6O/c12-9(18)7-8-2-5-17(6-3-8)10-1-4-14-11(15-10)16-13/h1,4,8H,2-3,5-7,13H2,(H2,12,18)(H,14,15,16)
InChIKeyBMXDQUKHIBAPJD-UHFFFAOYSA-N
XLogP-0.15
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 5-0.15
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'}

Analyze 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[1-(2-chloropyrimidin-4-yl)piperidin-4-yl]acetamide
CID 62341695
1-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]-N,N-dimethylmethanamine
CID 80904477
[4-(4-propan-2-ylpiperidin-1-yl)pyrimidin-2-yl]hydrazine
CID 103504775
1-[4-(2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanone
CID 80928222
[4-(4-cyclopropylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80895559
[4-(azocan-1-yl)pyrimidin-2-yl]hydrazine
CID 80932713
1-[2-(methylamino)pyrimidin-4-yl]piperidine-4-carboxamide
CID 80754186
2-[1-(6-chloropyridazin-3-yl)piperidin-4-yl]acetamide
CID 54987893
4-[4-(2-amino-2-oxoethyl)piperidin-1-yl]pyridine-3-carboxylic acid
CID 81243873
2-[1-(5-amino-6-cyano-2-pyridinyl)piperidin-4-yl]acetamide
CID 103467985
2-[1-(5-amino-6-methoxy-2-pyridinyl)piperidin-4-yl]acetamide
CID 54989449
2-[1-[2-(methylamino)pyrimidin-4-yl]piperidin-4-yl]-N-(pyrazin-2-ylmethyl)acetamide
CID 53189364

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The IUPAC name of 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide (CID 80904290) is 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide is NNc1nccc(N2CCC(CC(N)=O)CC2)n1.
What is the InChIKey of 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide?
The InChIKey is BMXDQUKHIBAPJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c12-9(18)7-8-2-5-17(6-3-8)10-1-4-14-11(15-10)16-13/h1,4,8H,2-3,5-7,13H2,(H2,12,18)(H,14,15,16).
What are the key properties of 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide?
2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide has a molecular weight of 250.31 g/mol, XLogP of -0.15, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-hydrazinylpyrimidin-4-yl)piperidin-4-yl]acetamide is sourced from PubChem (CID 80904290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).