N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide

C13H18N4O2 — CID 113038690

IUPACN-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)nn1)C1CCCO1
InChIInChI=1S/C13H18N4O2/c18-13(10-4-3-9-19-10)14-11-5-6-12(16-15-11)17-7-1-2-8-17/h5-6,10H,1-4,7-9H2,(H,14,15,18)
InChIKeyFLOQELNYIANXFF-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.19
Rot. Bonds3

About N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide

N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide (PubChem CID 113038690) has the molecular formula C13H18N4O2 and a molecular weight of 262.31 g/mol. Its IUPAC name is N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide
PubChem CID113038690
Molecular FormulaC13H18N4O2
Molecular Weight262.31 g/mol
Exact Mass262.14
IUPAC NameN-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide
SMILESO=C(Nc1ccc(N2CCCC2)nn1)C1CCCO1
InChIInChI=1S/C13H18N4O2/c18-13(10-4-3-9-19-10)14-11-5-6-12(16-15-11)17-7-1-2-8-17/h5-6,10H,1-4,7-9H2,(H,14,15,18)
InChIKeyFLOQELNYIANXFF-UHFFFAOYSA-N
XLogP1.19
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-[4-(2,3-dimethylphenyl)piperazin-1-yl]pyridazin-3-yl]oxolane-2-carboxamide
CID 113043707
N-[5-(4-pyrrolidin-1-ylanilino)-2-pyridinyl]oxolane-2-carboxamide
CID 113035628
N-[6-(diethylamino)pyridazin-3-yl]oxolane-2-carboxamide
CID 113043959
[4-(6-anilinopyridazin-3-yl)piperazin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 7178110
N-[4-(azepan-1-yl)phenyl]oxolane-2-carboxamide
CID 51197534
N-[6-(3-methylpiperidin-1-yl)pyridazin-3-yl]cyclopropanecarboxamide
CID 113045004
(2R)-N-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]oxolane-2-carboxamide
CID 42417081
N-[5-(4-phenylpiperazin-1-yl)-2-pyridinyl]oxolane-2-carboxamide
CID 113028796
(2S)-N-(5-iodo-2-pyridinyl)oxolane-2-carboxamide
CID 103873257
(2S)-N-(5-bromo-2-pyridinyl)oxolane-2-carboxamide
CID 7346608
N-(3-pyrrolidin-1-ylphenyl)oxolane-2-carboxamide
CID 47255294
6-[4-(oxolane-2-carbonyl)-1,4-diazepan-1-yl]pyridazine-3-carboxylic acid
CID 138386441

Frequently Asked Questions

What is the IUPAC name of N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide?
The IUPAC name of N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide (CID 113038690) is N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide?
The canonical SMILES for N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide is O=C(Nc1ccc(N2CCCC2)nn1)C1CCCO1.
What is the InChIKey of N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide?
The InChIKey is FLOQELNYIANXFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2/c18-13(10-4-3-9-19-10)14-11-5-6-12(16-15-11)17-7-1-2-8-17/h5-6,10H,1-4,7-9H2,(H,14,15,18).
What are the key properties of N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide?
N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide has a molecular weight of 262.31 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-pyrrolidin-1-ylpyridazin-3-yl)oxolane-2-carboxamide is sourced from PubChem (CID 113038690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).