6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine

C10H15ClN4 — CID 114478103

IUPAC6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine
SMILESClc1cc(NCCN2CCCC2)cnn1
InChIInChI=1S/C10H15ClN4/c11-10-7-9(8-13-14-10)12-3-6-15-4-1-2-5-15/h7-8H,1-6H2,(H,12,14)
InChIKeyKJDWSDFOCKYCKX-UHFFFAOYSA-N
MW226.71 g/mol
LogP1.64
Rot. Bonds4

About 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine

6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine (PubChem CID 114478103) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine.

Molecular Properties

Compound Name6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine
PubChem CID114478103
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine
SMILESClc1cc(NCCN2CCCC2)cnn1
InChIInChI=1S/C10H15ClN4/c11-10-7-9(8-13-14-10)12-3-6-15-4-1-2-5-15/h7-8H,1-6H2,(H,12,14)
InChIKeyKJDWSDFOCKYCKX-UHFFFAOYSA-N
XLogP1.64
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dichloro-N-(2-pyrrolidin-1-ylethyl)aniline
CID 82089741
3-N-ethyl-5-N-(2-pyrrolidin-1-ylethyl)pyridine-3,5-diamine
CID 113423980
4-chloro-N-(2-pyrrolidin-1-ylethyl)aniline
CID 62573511
6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-3-amine
CID 60674018
3-chloro-4-methyl-N-(2-piperidin-1-ylethyl)aniline
CID 54807377
3,5-dimethyl-N-(2-pyrrolidin-1-ylethyl)aniline
CID 82079424
N-[2-(azepan-1-yl)ethyl]-5-chloropyrimidin-2-amine
CID 79557528
1-N-[2-(azepan-1-yl)ethyl]-4-methylbenzene-1,3-diamine
CID 62911471
5-(2-piperidin-1-ylethylamino)pyridine-2-carbothioamide
CID 113320854
6-chloro-2-N-(2-pyrrolidin-1-ylethyl)pyridine-2,3-diamine
CID 24903988
4-N-[2-(azepan-1-yl)ethyl]benzene-1,2,4-triamine
CID 106750490
N-[2-(azepan-1-yl)ethyl]-6-chloro-2-(trifluoromethyl)pyrimidin-4-amine
CID 106194008

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine?
The IUPAC name of 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine (CID 114478103) is 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine.
What is the SMILES notation for 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine?
The canonical SMILES for 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine is Clc1cc(NCCN2CCCC2)cnn1.
What is the InChIKey of 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine?
The InChIKey is KJDWSDFOCKYCKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4/c11-10-7-9(8-13-14-10)12-3-6-15-4-1-2-5-15/h7-8H,1-6H2,(H,12,14).
What are the key properties of 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine?
6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine has a molecular weight of 226.71 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-pyrrolidin-1-ylethyl)pyridazin-4-amine is sourced from PubChem (CID 114478103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).