4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine

C11H17ClN4 — CID 117105087

IUPAC4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine
SMILESCC(C)N1CCC(c2cc(Cl)c(N)nn2)C1
InChIInChI=1S/C11H17ClN4/c1-7(2)16-4-3-8(6-16)10-5-9(12)11(13)15-14-10/h5,7-8H,3-4,6H2,1-2H3,(H2,13,15)
InChIKeyQXZRWVHTGINRJC-UHFFFAOYSA-N
MW240.74 g/mol
LogP1.91
Rot. Bonds2

About 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine

4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine (PubChem CID 117105087) has the molecular formula C11H17ClN4 and a molecular weight of 240.74 g/mol. Its IUPAC name is 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine.

Molecular Properties

Compound Name4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine
PubChem CID117105087
Molecular FormulaC11H17ClN4
Molecular Weight240.74 g/mol
Exact Mass240.11
IUPAC Name4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine
SMILESCC(C)N1CCC(c2cc(Cl)c(N)nn2)C1
InChIInChI=1S/C11H17ClN4/c1-7(2)16-4-3-8(6-16)10-5-9(12)11(13)15-14-10/h5,7-8H,3-4,6H2,1-2H3,(H2,13,15)
InChIKeyQXZRWVHTGINRJC-UHFFFAOYSA-N
XLogP1.91
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.74
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(1-propan-2-ylpiperidin-4-yl)pyridazin-3-amine
CID 117105205
2-chloro-1-methyl-5-(1-propan-2-ylpyrrolidin-3-yl)imidazole
CID 117259825
1-[2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-oxazol-5-yl]ethanamine
CID 115084987
2-chloro-5-(1-propan-2-ylpiperidin-4-yl)-1,3-oxazole
CID 117259550
6-chloro-5-(1-propan-2-ylpyrrolidin-3-yl)-1H-pyrimidin-2-one
CID 117260542
[3-(1-propan-2-ylpiperidin-3-yl)-1H-pyrazol-5-yl]methanamine
CID 115092470
4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine
CID 117105094
6-(1-methylpiperidin-3-yl)pyridazine-3,4-diamine
CID 117105593
1-[2-(1-propan-2-ylpyrrolidin-3-yl)-1,3-thiazol-5-yl]ethanamine
CID 115089818
3-phenyl-1-propan-2-ylpyrrolidine
CID 3447557
2-chloro-4-(1-propan-2-ylpiperidin-4-yl)pyridine
CID 66509908
5-[6-(1-propan-2-ylpiperidin-3-yl)-2-pyridinyl]pyridin-2-amine
CID 110254388

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine?
The IUPAC name of 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine (CID 117105087) is 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine.
What is the SMILES notation for 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine?
The canonical SMILES for 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine is CC(C)N1CCC(c2cc(Cl)c(N)nn2)C1.
What is the InChIKey of 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine?
The InChIKey is QXZRWVHTGINRJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN4/c1-7(2)16-4-3-8(6-16)10-5-9(12)11(13)15-14-10/h5,7-8H,3-4,6H2,1-2H3,(H2,13,15).
What are the key properties of 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine?
4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine has a molecular weight of 240.74 g/mol, XLogP of 1.91, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine is sourced from PubChem (CID 117105087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).