N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine

C15H19N5 — CID 133281245

IUPACN-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine
SMILESCN(CC1CCCN1c1cccnn1)c1ccccn1
InChIInChI=1S/C15H19N5/c1-19(14-7-2-3-9-16-14)12-13-6-5-11-20(13)15-8-4-10-17-18-15/h2-4,7-10,13H,5-6,11-12H2,1H3
InChIKeyGZVAMZQTFJBCCF-UHFFFAOYSA-N
MW269.35 g/mol
LogP1.98
Rot. Bonds4

About N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine

N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine (PubChem CID 133281245) has the molecular formula C15H19N5 and a molecular weight of 269.35 g/mol. Its IUPAC name is N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine
PubChem CID133281245
Molecular FormulaC15H19N5
Molecular Weight269.35 g/mol
Exact Mass269.16
IUPAC NameN-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine
SMILESCN(CC1CCCN1c1cccnn1)c1ccccn1
InChIInChI=1S/C15H19N5/c1-19(14-7-2-3-9-16-14)12-13-6-5-11-20(13)15-8-4-10-17-18-15/h2-4,7-10,13H,5-6,11-12H2,1H3
InChIKeyGZVAMZQTFJBCCF-UHFFFAOYSA-N
XLogP1.98
TPSA45.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine?
The IUPAC name of N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine (CID 133281245) is N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine.
What is the SMILES notation for N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine?
The canonical SMILES for N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine is CN(CC1CCCN1c1cccnn1)c1ccccn1.
What is the InChIKey of N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine?
The InChIKey is GZVAMZQTFJBCCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5/c1-19(14-7-2-3-9-16-14)12-13-6-5-11-20(13)15-8-4-10-17-18-15/h2-4,7-10,13H,5-6,11-12H2,1H3.
What are the key properties of N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine?
N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine has a molecular weight of 269.35 g/mol, XLogP of 1.98, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-pyridazin-3-ylpyrrolidin-2-yl)methyl]pyridin-2-amine is sourced from PubChem (CID 133281245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).