N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide

C14H17N5O — CID 133340260

IUPACN-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide
SMILESCCC(Nc1ccc(C(=O)NC)nn1)c1ccncc1
InChIInChI=1S/C14H17N5O/c1-3-11(10-6-8-16-9-7-10)17-13-5-4-12(18-19-13)14(20)15-2/h4-9,11H,3H2,1-2H3,(H,15,20)(H,17,19)
InChIKeyBKBYRFXHNKVYMT-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.79
Rot. Bonds5

About N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide

N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide (PubChem CID 133340260) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide
PubChem CID133340260
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC NameN-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide
SMILESCCC(Nc1ccc(C(=O)NC)nn1)c1ccncc1
InChIInChI=1S/C14H17N5O/c1-3-11(10-6-8-16-9-7-10)17-13-5-4-12(18-19-13)14(20)15-2/h4-9,11H,3H2,1-2H3,(H,15,20)(H,17,19)
InChIKeyBKBYRFXHNKVYMT-UHFFFAOYSA-N
XLogP1.79
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide (CID 133340260) is N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide is CCC(Nc1ccc(C(=O)NC)nn1)c1ccncc1.
What is the InChIKey of N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide?
The InChIKey is BKBYRFXHNKVYMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-3-11(10-6-8-16-9-7-10)17-13-5-4-12(18-19-13)14(20)15-2/h4-9,11H,3H2,1-2H3,(H,15,20)(H,17,19).
What are the key properties of N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide?
N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-(1-pyridin-4-ylpropylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 133340260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).