N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide

C15H20N6O2 — CID 136566330

IUPACN-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
SMILESCn1nccc1C(O)CNC(=O)c1ccc(N2CCCC2)nn1
InChIInChI=1S/C15H20N6O2/c1-20-12(6-7-17-20)13(22)10-16-15(23)11-4-5-14(19-18-11)21-8-2-3-9-21/h4-7,13,22H,2-3,8-10H2,1H3,(H,16,23)
InChIKeyUWLCZJMUJLLVSF-UHFFFAOYSA-N
MW316.37 g/mol
LogP0.27
Rot. Bonds5

About N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide

N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide (PubChem CID 136566330) has the molecular formula C15H20N6O2 and a molecular weight of 316.37 g/mol. Its IUPAC name is N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
PubChem CID136566330
Molecular FormulaC15H20N6O2
Molecular Weight316.37 g/mol
Exact Mass316.16
IUPAC NameN-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
SMILESCn1nccc1C(O)CNC(=O)c1ccc(N2CCCC2)nn1
InChIInChI=1S/C15H20N6O2/c1-20-12(6-7-17-20)13(22)10-16-15(23)11-4-5-14(19-18-11)21-8-2-3-9-21/h4-7,13,22H,2-3,8-10H2,1H3,(H,16,23)
InChIKeyUWLCZJMUJLLVSF-UHFFFAOYSA-N
XLogP0.27
TPSA96.17 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.37
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-amino-2-phenylethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
CID 119529366
4-[(6-pyrrolidin-1-ylpyridazine-3-carbonyl)amino]butanoic acid
CID 119352616
N-(2-cyclohexyl-3-hydroxypropyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 126806538
N-(2-aminoethyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide;dihydrochloride
CID 119385085
6-piperidin-1-yl-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109112480
N-pentyl-6-piperidin-1-ylpyridazine-3-carboxamide
CID 109112519
N-(2-hydroxy-2-phenylethyl)-6-spiro[4,5-dihydro-3H-1,5-benzoxazepine-2,4'-piperidine]-1'-ylpyridazine-3-carboxamide
CID 53231165
N-(2,2-dimethylpent-4-enyl)-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 122135933
N-(cyclobutylmethyl)-6-piperidin-1-ylpyridazine-3-carboxamide
CID 141463742
N-[(2S)-1-aminopropan-2-yl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide
CID 120508189
(2R)-3-methyl-2-[(6-pyrrolidin-1-ylpyridazine-3-carbonyl)amino]butanoic acid
CID 119368696
N-[(2S)-2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-3-methyl-4-morpholin-4-ylbenzamide
CID 164642958

Frequently Asked Questions

What is the IUPAC name of N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
The IUPAC name of N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide (CID 136566330) is N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide.
What is the SMILES notation for N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
The canonical SMILES for N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide is Cn1nccc1C(O)CNC(=O)c1ccc(N2CCCC2)nn1.
What is the InChIKey of N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
The InChIKey is UWLCZJMUJLLVSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O2/c1-20-12(6-7-17-20)13(22)10-16-15(23)11-4-5-14(19-18-11)21-8-2-3-9-21/h4-7,13,22H,2-3,8-10H2,1H3,(H,16,23).
What are the key properties of N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide?
N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide has a molecular weight of 316.37 g/mol, XLogP of 0.27, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-hydroxy-2-(2-methylpyrazol-3-yl)ethyl]-6-pyrrolidin-1-ylpyridazine-3-carboxamide is sourced from PubChem (CID 136566330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).