6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine

C14H23ClN4 — CID 55168144

IUPAC6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine
SMILESCc1c(Cl)nnc(NC(C)CN2CCCCC2)c1C
InChIInChI=1S/C14H23ClN4/c1-10(9-19-7-5-4-6-8-19)16-14-12(3)11(2)13(15)17-18-14/h10H,4-9H2,1-3H3,(H,16,18)
InChIKeyOBDUHPIMAOPIIF-UHFFFAOYSA-N
MW282.82 g/mol
LogP3.03
Rot. Bonds4

About 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine

6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine (PubChem CID 55168144) has the molecular formula C14H23ClN4 and a molecular weight of 282.82 g/mol. Its IUPAC name is 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine
PubChem CID55168144
Molecular FormulaC14H23ClN4
Molecular Weight282.82 g/mol
Exact Mass282.16
IUPAC Name6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine
SMILESCc1c(Cl)nnc(NC(C)CN2CCCCC2)c1C
InChIInChI=1S/C14H23ClN4/c1-10(9-19-7-5-4-6-8-19)16-14-12(3)11(2)13(15)17-18-14/h10H,4-9H2,1-3H3,(H,16,18)
InChIKeyOBDUHPIMAOPIIF-UHFFFAOYSA-N
XLogP3.03
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.82
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,6-dichloro-N-(1-piperidin-1-ylpropan-2-yl)-1,2,4-triazin-5-amine
CID 81036944
6-chloro-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,5-diamine
CID 63022906
2,5-dimethyl-4-N-(1-piperidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80801780
6-chloro-N-hexan-2-yl-4,5-dimethylpyridazin-3-amine
CID 63271524
6-chloro-N-(1-piperidin-1-ylpropan-2-yl)-5-propylpyrimidin-4-amine
CID 63729469
6-hydrazinyl-2,5-dimethyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 80897399
6-N-ethyl-2,5-dimethyl-4-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidine-4,6-diamine
CID 80801137
3,5-dichloro-N-(1-pyrrolidin-1-ylpropan-2-yl)pyridin-2-amine
CID 61222948
6-chloro-5-propyl-N-(1-pyrrolidin-1-ylpropan-2-yl)pyrimidin-4-amine
CID 63728295
4-chloro-6-(1-pyrrolidin-1-ylpropan-2-ylamino)pyrimidine-5-carbaldehyde
CID 66366326
3-bromo-4-methyl-N-(1-piperidin-1-ylpropan-2-yl)pyridin-2-amine
CID 106875617
6-chloro-4-N-methyl-2-N-(1-piperidin-1-ylpropan-2-yl)-1,3,5-triazine-2,4-diamine
CID 80801538

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine?
The IUPAC name of 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine (CID 55168144) is 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine is Cc1c(Cl)nnc(NC(C)CN2CCCCC2)c1C.
What is the InChIKey of 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine?
The InChIKey is OBDUHPIMAOPIIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23ClN4/c1-10(9-19-7-5-4-6-8-19)16-14-12(3)11(2)13(15)17-18-14/h10H,4-9H2,1-3H3,(H,16,18).
What are the key properties of 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine?
6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine has a molecular weight of 282.82 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4,5-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)pyridazin-3-amine is sourced from PubChem (CID 55168144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).