6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine

C11H18ClN3O — CID 81062603

IUPAC6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine
SMILESCCOCCN(C)c1nnc(Cl)c(C)c1C
InChIInChI=1S/C11H18ClN3O/c1-5-16-7-6-15(4)11-9(3)8(2)10(12)13-14-11/h5-7H2,1-4H3
InChIKeyCMIADZBZPNPJNI-UHFFFAOYSA-N
MW243.74 g/mol
LogP2.22
Rot. Bonds5

About 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine

6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine (PubChem CID 81062603) has the molecular formula C11H18ClN3O and a molecular weight of 243.74 g/mol. Its IUPAC name is 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine
PubChem CID81062603
Molecular FormulaC11H18ClN3O
Molecular Weight243.74 g/mol
Exact Mass243.11
IUPAC Name6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine
SMILESCCOCCN(C)c1nnc(Cl)c(C)c1C
InChIInChI=1S/C11H18ClN3O/c1-5-16-7-6-15(4)11-9(3)8(2)10(12)13-14-11/h5-7H2,1-4H3
InChIKeyCMIADZBZPNPJNI-UHFFFAOYSA-N
XLogP2.22
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.74
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N,4,5-trimethyl-N-(2-propan-2-yloxyethyl)pyridazin-3-amine
CID 81061968
5-[(6-chloro-4,5-dimethylpyridazin-3-yl)-methylamino]pentan-1-ol
CID 107201841
4-N-(2-ethoxyethyl)-2-ethyl-4-N,5-dimethylpyrimidine-4,6-diamine
CID 81067549
N-[(4-bromophenyl)methyl]-6-chloro-N,4,5-trimethylpyridazin-3-amine
CID 63272064
2-chloro-N-(2-ethoxyethyl)-N,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 103322184
6-chloro-2-N-(2-ethoxyethyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 81061963
4-N-(2-ethoxyethyl)-4-N,5-dimethyl-6-N-propylpyrimidine-4,6-diamine
CID 81068418
6-chloro-N-[(2-methoxyphenyl)methyl]-N,4,5-trimethylpyridazin-3-amine
CID 63271464
6-chloro-N,4,5-trimethyl-N-[(5-methylfuran-2-yl)methyl]pyridazin-3-amine
CID 63271589
5-(2-chloroethyl)-N-(2-ethoxyethyl)-N-methyl-1,3,4-oxadiazol-2-amine
CID 106958155
5-chloro-4-N-(2-ethoxyethyl)-2-N-ethyl-4-N-methylpyrimidine-2,4-diamine
CID 81067674
2-[(6-chloro-4,5-dimethylpyridazin-3-yl)-pentan-3-ylamino]ethanol
CID 63271902

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine?
The IUPAC name of 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine (CID 81062603) is 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine is CCOCCN(C)c1nnc(Cl)c(C)c1C.
What is the InChIKey of 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine?
The InChIKey is CMIADZBZPNPJNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18ClN3O/c1-5-16-7-6-15(4)11-9(3)8(2)10(12)13-14-11/h5-7H2,1-4H3.
What are the key properties of 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine?
6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine has a molecular weight of 243.74 g/mol, XLogP of 2.22, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-ethoxyethyl)-N,4,5-trimethylpyridazin-3-amine is sourced from PubChem (CID 81062603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).