N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide

C19H27N7O — CID 109124196

IUPACN,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
SMILESCCCN(CCC)C(=O)c1ccc(N2CCN(c3ncccn3)CC2)nn1
InChIInChI=1S/C19H27N7O/c1-3-10-25(11-4-2)18(27)16-6-7-17(23-22-16)24-12-14-26(15-13-24)19-20-8-5-9-21-19/h5-9H,3-4,10-15H2,1-2H3
InChIKeyPVYPVTKJLSZNKV-UHFFFAOYSA-N
MW369.47 g/mol
LogP1.86
Rot. Bonds7

About N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide

N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide (PubChem CID 109124196) has the molecular formula C19H27N7O and a molecular weight of 369.47 g/mol. Its IUPAC name is N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
PubChem CID109124196
Molecular FormulaC19H27N7O
Molecular Weight369.47 g/mol
Exact Mass369.23
IUPAC NameN,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
SMILESCCCN(CCC)C(=O)c1ccc(N2CCN(c3ncccn3)CC2)nn1
InChIInChI=1S/C19H27N7O/c1-3-10-25(11-4-2)18(27)16-6-7-17(23-22-16)24-12-14-26(15-13-24)19-20-8-5-9-21-19/h5-9H,3-4,10-15H2,1-2H3
InChIKeyPVYPVTKJLSZNKV-UHFFFAOYSA-N
XLogP1.86
TPSA78.35 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

6-(4-phenylpiperazin-1-yl)-N,N-dipropylpyridazine-3-carboxamide
CID 109123102
6-(4-formylpiperazin-1-yl)-N,N-dipropylpyridazine-3-carboxamide
CID 109116830
6-[4-(2-methoxyphenyl)piperazin-1-yl]-N,N-dipropylpyridazine-3-carboxamide
CID 109123968
N-(2-ethylphenyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109124209
N-butyl-N-methyl-6-(4-methylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109116180
N-propyl-6-(4-pyridin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109109270
ethyl N-[6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazin-3-yl]carbamate
CID 113043939
N,N-diethyl-6-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109098942
5-(4-acetylpiperazin-1-yl)-N,N-dipropylpyrazine-2-carboxamide
CID 109279210
6-cyclopropyl-N,N-dipropylpyridazine-3-carboxamide
CID 113200208
N-(4-cyanophenyl)-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109124224
2-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-N,N-dipropylpyrimidine-4-carboxamide
CID 109309927

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide (CID 109124196) is N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide is CCCN(CCC)C(=O)c1ccc(N2CCN(c3ncccn3)CC2)nn1.
What is the InChIKey of N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide?
The InChIKey is PVYPVTKJLSZNKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N7O/c1-3-10-25(11-4-2)18(27)16-6-7-17(23-22-16)24-12-14-26(15-13-24)19-20-8-5-9-21-19/h5-9H,3-4,10-15H2,1-2H3.
What are the key properties of N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide?
N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide has a molecular weight of 369.47 g/mol, XLogP of 1.86, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 109124196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).