6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine

C10H15ClN4 — CID 97164559

IUPAC6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
SMILESCN(C[C@@H]1CCNC1)c1ccc(Cl)nn1
InChIInChI=1S/C10H15ClN4/c1-15(7-8-4-5-12-6-8)10-3-2-9(11)13-14-10/h2-3,8,12H,4-7H2,1H3/t8-/m1/s1
InChIKeyDGVGWTQSRVKTRZ-MRVPVSSYSA-N
MW226.71 g/mol
LogP1.18
Rot. Bonds3

About 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine

6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine (PubChem CID 97164559) has the molecular formula C10H15ClN4 and a molecular weight of 226.71 g/mol. Its IUPAC name is 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
PubChem CID97164559
Molecular FormulaC10H15ClN4
Molecular Weight226.71 g/mol
Exact Mass226.10
IUPAC Name6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
SMILESCN(C[C@@H]1CCNC1)c1ccc(Cl)nn1
InChIInChI=1S/C10H15ClN4/c1-15(7-8-4-5-12-6-8)10-3-2-9(11)13-14-10/h2-3,8,12H,4-7H2,1H3/t8-/m1/s1
InChIKeyDGVGWTQSRVKTRZ-MRVPVSSYSA-N
XLogP1.18
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.71
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-methyl-N-(piperidin-4-ylmethyl)pyridazin-3-amine;hydrochloride
CID 71642379
N,6-dimethyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 97164558
6-chloro-N-(cyclopentylmethyl)-N-methylpyridazin-3-amine
CID 63655754
6-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)pyridazin-3-amine
CID 116973542
N-methyl-6-phenyl-N-(pyrrolidin-3-ylmethyl)pyridazin-3-amine
CID 116973535
N-methyl-N-(pyrrolidin-3-ylmethyl)-1,2,4-triazin-6-amine
CID 112709657
3-chloro-6-(pyrrolidin-3-ylmethyl)pyridazine
CID 117105313
5-chloro-N-methyl-N-(pyrrolidin-3-ylmethyl)thiophen-2-amine
CID 115208661
5-chloro-N-methyl-N-(piperidin-4-ylmethyl)pyridin-2-amine
CID 79719724
6-chloro-N-methyl-N-piperidin-3-ylpyridazin-3-amine
CID 63642703
6-chloro-N-propyl-N-pyrrolidin-3-ylpyridazin-3-amine
CID 63304490
6-bromo-N-methyl-N-(pyrrolidin-3-ylmethyl)pyridin-2-amine;hydrochloride
CID 71642240

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine?
The IUPAC name of 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine (CID 97164559) is 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine is CN(C[C@@H]1CCNC1)c1ccc(Cl)nn1.
What is the InChIKey of 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine?
The InChIKey is DGVGWTQSRVKTRZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H15ClN4/c1-15(7-8-4-5-12-6-8)10-3-2-9(11)13-14-10/h2-3,8,12H,4-7H2,1H3/t8-/m1/s1.
What are the key properties of 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine?
6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine has a molecular weight of 226.71 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pyridazin-3-amine is sourced from PubChem (CID 97164559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).