N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide

C13H21N5O — CID 114794623

IUPACN,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCC2CCCN2)nn1
InChIInChI=1S/C13H21N5O/c1-18(2)13(19)11-5-6-12(17-16-11)15-9-7-10-4-3-8-14-10/h5-6,10,14H,3-4,7-9H2,1-2H3,(H,15,17)
InChIKeyPPYIVINBLNKAHF-UHFFFAOYSA-N
MW263.34 g/mol
LogP0.73
Rot. Bonds5

About N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide

N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide (PubChem CID 114794623) has the molecular formula C13H21N5O and a molecular weight of 263.34 g/mol. Its IUPAC name is N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide
PubChem CID114794623
Molecular FormulaC13H21N5O
Molecular Weight263.34 g/mol
Exact Mass263.17
IUPAC NameN,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide
SMILESCN(C)C(=O)c1ccc(NCCC2CCCN2)nn1
InChIInChI=1S/C13H21N5O/c1-18(2)13(19)11-5-6-12(17-16-11)15-9-7-10-4-3-8-14-10/h5-6,10,14H,3-4,7-9H2,1-2H3,(H,15,17)
InChIKeyPPYIVINBLNKAHF-UHFFFAOYSA-N
XLogP0.73
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-6-(trifluoromethyl)pyridazin-3-amine
CID 104973215
2-N,2-N-dimethyl-4-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrimidine-2,4-diamine
CID 104972916
methyl 6-(2-pyrrolidin-2-ylethylamino)pyrazine-2-carboxylate
CID 114794650
6-(2-piperidin-2-ylethylamino)pyrazine-2-carboxamide
CID 122572843
N-cyclopentyl-6-(ethylamino)-N-methylpyridazine-3-carboxamide
CID 62168959
3,3-dimethyl-N-(2-pyrrolidin-2-ylethyl)butanamide
CID 114793955
1-methyl-N-[2-[(2S)-pyrrolidin-2-yl]ethyl]pyrrole-2-carboxamide
CID 104955194
N-[2-[(2S)-pyrrolidin-2-yl]ethyl]-6,7-dihydro-5H-cyclopenta[b]pyridin-2-amine
CID 104973469
5-bromo-2-[2-[(2S)-pyrrolidin-2-yl]ethylamino]benzamide
CID 104982774
1-ethyl-1-methyl-3-(2-pyrrolidin-2-ylethyl)urea
CID 114794049
6-chloro-N-[2-[(2R)-pyrrolidin-2-yl]ethyl]pyrazin-2-amine
CID 104973220
N,N-dimethyl-6-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethylamino]pyridazine-3-carboxamide
CID 106418721

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide?
The IUPAC name of N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide (CID 114794623) is N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide is CN(C)C(=O)c1ccc(NCCC2CCCN2)nn1.
What is the InChIKey of N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide?
The InChIKey is PPYIVINBLNKAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O/c1-18(2)13(19)11-5-6-12(17-16-11)15-9-7-10-4-3-8-14-10/h5-6,10,14H,3-4,7-9H2,1-2H3,(H,15,17).
What are the key properties of N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide?
N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-(2-pyrrolidin-2-ylethylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 114794623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).