6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine

C10H16ClN3O — CID 63271760

IUPAC6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine
SMILESCOCCCNc1nnc(Cl)c(C)c1C
InChIInChI=1S/C10H16ClN3O/c1-7-8(2)10(14-13-9(7)11)12-5-4-6-15-3/h4-6H2,1-3H3,(H,12,14)
InChIKeyGCSWTYRAAZMVPR-UHFFFAOYSA-N
MW229.71 g/mol
LogP2.20
Rot. Bonds5

About 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine

6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine (PubChem CID 63271760) has the molecular formula C10H16ClN3O and a molecular weight of 229.71 g/mol. Its IUPAC name is 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine
PubChem CID63271760
Molecular FormulaC10H16ClN3O
Molecular Weight229.71 g/mol
Exact Mass229.10
IUPAC Name6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine
SMILESCOCCCNc1nnc(Cl)c(C)c1C
InChIInChI=1S/C10H16ClN3O/c1-7-8(2)10(14-13-9(7)11)12-5-4-6-15-3/h4-6H2,1-3H3,(H,12,14)
InChIKeyGCSWTYRAAZMVPR-UHFFFAOYSA-N
XLogP2.20
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.71
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[(6-chloro-4,5-dimethylpyridazin-3-yl)amino]butanamide
CID 63271549
6-chloro-4,5-dimethyl-N-(2-phenoxyethyl)pyridazin-3-amine
CID 63271688
6-chloro-4,5-dimethyl-N-(3-phenylpropyl)pyridazin-3-amine
CID 63271631
6-chloro-4,5-dimethyl-N-[(E)-pent-3-enyl]pyridazin-3-amine
CID 106195870
6-chloro-N-(2-methoxypropyl)-4,5-dimethylpyridazin-3-amine
CID 102699930
6-chloro-4,5-dimethyl-N-(3-morpholin-4-ylpropyl)pyridazin-3-amine
CID 55169476
6-chloro-N-[[2-(methoxymethyl)phenyl]methyl]-4,5-dimethylpyridazin-3-amine
CID 106192887
6-chloro-4,5-dimethyl-N-(2,2,2-trifluoroethyl)pyridazin-3-amine
CID 63271501
6-chloro-N,4,5-trimethylpyridazin-3-amine
CID 63271800
6-chloro-N-[(3-methoxyphenyl)methyl]-4,5-dimethylpyridazin-3-amine
CID 63271766
6-chloro-N-[2-(5-chlorothiophen-2-yl)ethyl]-4,5-dimethylpyridazin-3-amine
CID 106038485
4-N-(3-methoxypropyl)-5-methylpyrimidine-4,6-diamine
CID 80772369

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine?
The IUPAC name of 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine (CID 63271760) is 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine is COCCCNc1nnc(Cl)c(C)c1C.
What is the InChIKey of 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine?
The InChIKey is GCSWTYRAAZMVPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN3O/c1-7-8(2)10(14-13-9(7)11)12-5-4-6-15-3/h4-6H2,1-3H3,(H,12,14).
What are the key properties of 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine?
6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine has a molecular weight of 229.71 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-methoxypropyl)-4,5-dimethylpyridazin-3-amine is sourced from PubChem (CID 63271760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).