N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide

C12H19N5O — CID 115300830

IUPACN,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide
SMILESCNC1CCN(c2ccc(C(=O)N(C)C)nn2)C1
InChIInChI=1S/C12H19N5O/c1-13-9-6-7-17(8-9)11-5-4-10(14-15-11)12(18)16(2)3/h4-5,9,13H,6-8H2,1-3H3
InChIKeyISKKMFQNCXHYRW-UHFFFAOYSA-N
MW249.32 g/mol
LogP-0.02
Rot. Bonds3

About N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide

N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide (PubChem CID 115300830) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide
PubChem CID115300830
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC NameN,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide
SMILESCNC1CCN(c2ccc(C(=O)N(C)C)nn2)C1
InChIInChI=1S/C12H19N5O/c1-13-9-6-7-17(8-9)11-5-4-10(14-15-11)12(18)16(2)3/h4-5,9,13H,6-8H2,1-3H3
InChIKeyISKKMFQNCXHYRW-UHFFFAOYSA-N
XLogP-0.02
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide
CID 113282123
6-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyridazine-3-carboxamide
CID 133329265
N,N-dimethyl-6-(4-phenylmethoxypiperidin-1-yl)pyridazine-3-carboxamide
CID 136547748
6-[4-(2-hydroxyethoxy)piperidin-1-yl]-N,N-dimethylpyridazine-3-carboxamide
CID 82684600
methyl 6-[(3S)-3-anilinopyrrolidin-1-yl]pyridazine-3-carboxylate
CID 96524339
6-[4-(benzimidazol-1-yl)piperidin-1-yl]-N,N-dimethylpyridazine-3-carboxamide
CID 166307167
1-(6-cyclobutylpyridazin-3-yl)-N-methylpyrrolidin-3-amine
CID 116972984
[(3R)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]carbamic acid
CID 129161486
[(3R)-3-(methylamino)piperidin-1-yl]-(6-pyrrolidin-1-ylpyridazin-3-yl)methanone
CID 124587818
5-[3-(methylamino)pyrrolidin-1-yl]pyrazine-2-carboxamide
CID 175889178
N-ethyl-6-[(3S)-3-hydroxypyrrolidin-1-yl]pyridazine-3-carboxamide
CID 113254513
(3R)-N-methyl-1-pyridazin-3-ylpyrrolidin-3-amine
CID 177337485

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide?
The IUPAC name of N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide (CID 115300830) is N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide?
The canonical SMILES for N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide is CNC1CCN(c2ccc(C(=O)N(C)C)nn2)C1.
What is the InChIKey of N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide?
The InChIKey is ISKKMFQNCXHYRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-13-9-6-7-17(8-9)11-5-4-10(14-15-11)12(18)16(2)3/h4-5,9,13H,6-8H2,1-3H3.
What are the key properties of N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide?
N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide has a molecular weight of 249.32 g/mol, XLogP of -0.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-[3-(methylamino)pyrrolidin-1-yl]pyridazine-3-carboxamide is sourced from PubChem (CID 115300830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).