CID 102298125

C5H5N2 — CID 102298125

IUPAC—
SMILES[CH2]c1cccnn1
InChIInChI=1S/C5H5N2/c1-5-3-2-4-6-7-5/h2-4H,1H2
InChIKeyKHWUXNKSJCBFBT-UHFFFAOYSA-N
MW93.11 g/mol
LogP0.66
Rot. Bonds

About CID 102298125

CID 102298125 (PubChem CID 102298125) has the molecular formula C5H5N2 and a molecular weight of 93.11 g/mol.

Molecular Properties

Compound NameCID 102298125
PubChem CID102298125
Molecular FormulaC5H5N2
Molecular Weight93.11 g/mol
Exact Mass93.05
IUPAC Name—
SMILES[CH2]c1cccnn1
InChIInChI=1S/C5H5N2/c1-5-3-2-4-6-7-5/h2-4H,1H2
InChIKeyKHWUXNKSJCBFBT-UHFFFAOYSA-N
XLogP0.66
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.11
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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3-(6-pyridazin-3-yl-2-pyridinyl)pyridazine
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ethane;pyridazin-3-amine
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N-(1-pyridazin-3-ylethylidene)hydroxylamine
CID 137185184
3-(difluoromethoxy)pyridazine
CID 91499566
3-(4-methylidenepiperidin-1-yl)pyridazine
CID 126992423
3-ethynylpyridazine
CID 66524480
3-(trichloromethyl)pyridazine
CID 18471457
pyridazin-3-yl methanesulfinate
CID 59940021
3-imidazol-1-ylpyridazine
CID 19095571

Frequently Asked Questions

What is the IUPAC name of CID 102298125?
The IUPAC name of CID 102298125 (CID 102298125) is not available.
What is the SMILES notation for CID 102298125?
The canonical SMILES for CID 102298125 is [CH2]c1cccnn1.
What is the InChIKey of CID 102298125?
The InChIKey is KHWUXNKSJCBFBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N2/c1-5-3-2-4-6-7-5/h2-4H,1H2.
What are the key properties of CID 102298125?
CID 102298125 has a molecular weight of 93.11 g/mol, XLogP of 0.66, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102298125 is sourced from PubChem (CID 102298125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).