6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine

C16H19Cl2N5 — CID 154802923

IUPAC6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine
SMILESCN(C)c1ccc(C2CCCN2Cc2ncc(Cl)cc2Cl)nn1
InChIInChI=1S/C16H19Cl2N5/c1-22(2)16-6-5-13(20-21-16)15-4-3-7-23(15)10-14-12(18)8-11(17)9-19-14/h5-6,8-9,15H,3-4,7,10H2,1-2H3
InChIKeyRMSVJQDFMFKTPF-UHFFFAOYSA-N
MW352.27 g/mol
LogP3.58
Rot. Bonds4

About 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine

6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine (PubChem CID 154802923) has the molecular formula C16H19Cl2N5 and a molecular weight of 352.27 g/mol. Its IUPAC name is 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine.

Molecular Properties

Compound Name6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine
PubChem CID154802923
Molecular FormulaC16H19Cl2N5
Molecular Weight352.27 g/mol
Exact Mass351.10
IUPAC Name6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine
SMILESCN(C)c1ccc(C2CCCN2Cc2ncc(Cl)cc2Cl)nn1
InChIInChI=1S/C16H19Cl2N5/c1-22(2)16-6-5-13(20-21-16)15-4-3-7-23(15)10-14-12(18)8-11(17)9-19-14/h5-6,8-9,15H,3-4,7,10H2,1-2H3
InChIKeyRMSVJQDFMFKTPF-UHFFFAOYSA-N
XLogP3.58
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.27
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine with MolForge

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Related Compounds

3,5-dichloro-2-[[(2R)-2-(5-methyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methyl]pyridine
CID 129492265
6-[(2S)-1-[(3-fluoro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N,2-trimethylpyrimidin-4-amine
CID 124955563
6-[1-[(3-fluoro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N,2-trimethylpyrimidin-4-amine
CID 110113735
N,N-dimethyl-4-[(2S)-1-[(5-methyl-1H-imidazol-4-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine
CID 124973491
N,N-dimethyl-6-[(2R)-1-(1,3-thiazol-2-ylmethyl)pyrrolidin-2-yl]pyrazin-2-amine
CID 125005171
N,N,2-trimethyl-6-[(2S)-1-(1,3-thiazol-4-ylmethyl)pyrrolidin-2-yl]pyrimidin-4-amine
CID 124948743
N,N-dimethyl-4-[1-[(3-methylimidazol-4-yl)methyl]pyrrolidin-2-yl]pyridin-2-amine
CID 127244780
N,N,2-trimethyl-6-[1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]pyridin-4-amine
CID 110256927
2-[(2S)-1-[(2-chloro-4-fluorophenyl)methyl]pyrrolidin-2-yl]pyrazine
CID 124955216
2-[1-(pyridin-4-ylmethyl)pyrrolidin-2-yl]pyrazine
CID 73440222
5-(1-benzylpyrrolidin-2-yl)-N,N,3-trimethylpyridin-2-amine
CID 102542845
6-[1-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]pyridazin-3-amine
CID 167797903

Frequently Asked Questions

What is the IUPAC name of 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine?
The IUPAC name of 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine (CID 154802923) is 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine.
What is the SMILES notation for 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine?
The canonical SMILES for 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine is CN(C)c1ccc(C2CCCN2Cc2ncc(Cl)cc2Cl)nn1.
What is the InChIKey of 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine?
The InChIKey is RMSVJQDFMFKTPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19Cl2N5/c1-22(2)16-6-5-13(20-21-16)15-4-3-7-23(15)10-14-12(18)8-11(17)9-19-14/h5-6,8-9,15H,3-4,7,10H2,1-2H3.
What are the key properties of 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine?
6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine has a molecular weight of 352.27 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-[(3,5-dichloro-2-pyridinyl)methyl]pyrrolidin-2-yl]-N,N-dimethylpyridazin-3-amine is sourced from PubChem (CID 154802923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).