6-chloro-N-ethyl-N-propylpyridazin-4-amine

C9H14ClN3 — CID 114478465

IUPAC6-chloro-N-ethyl-N-propylpyridazin-4-amine
SMILESCCCN(CC)c1cnnc(Cl)c1
InChIInChI=1S/C9H14ClN3/c1-3-5-13(4-2)8-6-9(10)12-11-7-8/h6-7H,3-5H2,1-2H3
InChIKeyXSGAMFSTKPNDQZ-UHFFFAOYSA-N
MW199.69 g/mol
LogP2.37
Rot. Bonds4

About 6-chloro-N-ethyl-N-propylpyridazin-4-amine

6-chloro-N-ethyl-N-propylpyridazin-4-amine (PubChem CID 114478465) has the molecular formula C9H14ClN3 and a molecular weight of 199.69 g/mol. Its IUPAC name is 6-chloro-N-ethyl-N-propylpyridazin-4-amine.

Molecular Properties

Compound Name6-chloro-N-ethyl-N-propylpyridazin-4-amine
PubChem CID114478465
Molecular FormulaC9H14ClN3
Molecular Weight199.69 g/mol
Exact Mass199.09
IUPAC Name6-chloro-N-ethyl-N-propylpyridazin-4-amine
SMILESCCCN(CC)c1cnnc(Cl)c1
InChIInChI=1S/C9H14ClN3/c1-3-5-13(4-2)8-6-9(10)12-11-7-8/h6-7H,3-5H2,1-2H3
InChIKeyXSGAMFSTKPNDQZ-UHFFFAOYSA-N
XLogP2.37
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.69
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(6-chloropyridazin-4-yl)-N,N-dimethyl-N'-propylethane-1,2-diamine
CID 114478238
6-chloro-5-methyl-N,N-dipropylpyridin-3-amine
CID 82225042
3-N-ethyl-3-N-propylbenzene-1,3-diamine
CID 43268426
6-chloro-4-N,4-N-diethylpyridine-3,4-diamine
CID 115021883
2-N-ethyl-2-N-propylpyridine-2,4,5-triamine
CID 144872693
6-chloro-N-ethylpyridazin-4-amine
CID 88853962
3-chloro-5-methylpyridazine;dichloromethane
CID 163342385
2-tert-butyl-6-chloro-N-ethyl-N-propylpyrimidin-4-amine
CID 80953542
ethane;N-ethyl-4-propan-2-yl-N-propylaniline
CID 145169701
3-N-methyl-5-N,5-N-dipropylpyridine-3,5-diamine
CID 104532476
4-[ethyl(propyl)amino]-2-fluorobenzenecarbothioamide
CID 115367915
2-N-ethyl-5-methyl-2-N-propylpyridine-2,3-diamine
CID 66278862

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-ethyl-N-propylpyridazin-4-amine?
The IUPAC name of 6-chloro-N-ethyl-N-propylpyridazin-4-amine (CID 114478465) is 6-chloro-N-ethyl-N-propylpyridazin-4-amine.
What is the SMILES notation for 6-chloro-N-ethyl-N-propylpyridazin-4-amine?
The canonical SMILES for 6-chloro-N-ethyl-N-propylpyridazin-4-amine is CCCN(CC)c1cnnc(Cl)c1.
What is the InChIKey of 6-chloro-N-ethyl-N-propylpyridazin-4-amine?
The InChIKey is XSGAMFSTKPNDQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3/c1-3-5-13(4-2)8-6-9(10)12-11-7-8/h6-7H,3-5H2,1-2H3.
What are the key properties of 6-chloro-N-ethyl-N-propylpyridazin-4-amine?
6-chloro-N-ethyl-N-propylpyridazin-4-amine has a molecular weight of 199.69 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-ethyl-N-propylpyridazin-4-amine is sourced from PubChem (CID 114478465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).