6-chloro-N-pyrimidin-5-ylpyridazin-3-amine

C8H6ClN5 — CID 155284638

IUPAC6-chloro-N-pyrimidin-5-ylpyridazin-3-amine
SMILESClc1ccc(Nc2cncnc2)nn1
InChIInChI=1S/C8H6ClN5/c9-7-1-2-8(14-13-7)12-6-3-10-5-11-4-6/h1-5H,(H,12,14)
InChIKeyKCDNWUVFXOGZFU-UHFFFAOYSA-N
MW207.62 g/mol
LogP1.66
Rot. Bonds2

About 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine

6-chloro-N-pyrimidin-5-ylpyridazin-3-amine (PubChem CID 155284638) has the molecular formula C8H6ClN5 and a molecular weight of 207.62 g/mol. Its IUPAC name is 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-pyrimidin-5-ylpyridazin-3-amine
PubChem CID155284638
Molecular FormulaC8H6ClN5
Molecular Weight207.62 g/mol
Exact Mass207.03
IUPAC Name6-chloro-N-pyrimidin-5-ylpyridazin-3-amine
SMILESClc1ccc(Nc2cncnc2)nn1
InChIInChI=1S/C8H6ClN5/c9-7-1-2-8(14-13-7)12-6-3-10-5-11-4-6/h1-5H,(H,12,14)
InChIKeyKCDNWUVFXOGZFU-UHFFFAOYSA-N
XLogP1.66
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.62
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-chloro-N-(4-methylphenyl)pyridazin-3-amine
CID 6409839
6-chloro-N-(3,4-difluorophenyl)pyridazin-3-amine
CID 43151751
6-chloro-N-(3-iodophenyl)pyridazin-3-amine
CID 43090226
2-[4-[(6-chloropyridazin-3-yl)amino]anilino]ethene-1,1,2-tricarbonitrile
CID 168608704
6-chloro-N-(3-propan-2-ylphenyl)pyridazin-3-amine
CID 43090207
6-chloro-N-[4-(furan-2-yl)phenyl]pyridazin-3-amine
CID 168526807
6-chloro-N-(4-morpholin-4-ylphenyl)pyridazin-3-amine
CID 60674960
N-(2-chlorophenyl)pyrimidin-5-amine
CID 82536995
2-[4-[(6-chloropyridazin-3-yl)amino]phenyl]isoindole-1,3-dione
CID 168518113
6-chloro-N-[3-(trifluoromethoxy)phenyl]pyridazin-3-amine
CID 43151729
6-chloro-N-(4-chloro-2,5-dimethoxyphenyl)pyridazin-3-amine
CID 43329630
N-(6-chloropyridazin-3-yl)formamide
CID 12924250

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine?
The IUPAC name of 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine (CID 155284638) is 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine?
The canonical SMILES for 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine is Clc1ccc(Nc2cncnc2)nn1.
What is the InChIKey of 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine?
The InChIKey is KCDNWUVFXOGZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6ClN5/c9-7-1-2-8(14-13-7)12-6-3-10-5-11-4-6/h1-5H,(H,12,14).
What are the key properties of 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine?
6-chloro-N-pyrimidin-5-ylpyridazin-3-amine has a molecular weight of 207.62 g/mol, XLogP of 1.66, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-pyrimidin-5-ylpyridazin-3-amine is sourced from PubChem (CID 155284638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).