(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide

C9H12N4O — CID 104901521

IUPAC(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide
SMILESO=C(Nc1cccnn1)[C@H]1CCCN1
InChIInChI=1S/C9H12N4O/c14-9(7-3-1-5-10-7)12-8-4-2-6-11-13-8/h2,4,6-7,10H,1,3,5H2,(H,12,13,14)/t7-/m1/s1
InChIKeyCIRPZBRERXVLDZ-SSDOTTSWSA-N
MW192.22 g/mol
LogP0.17
Rot. Bonds2

About (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide

(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide (PubChem CID 104901521) has the molecular formula C9H12N4O and a molecular weight of 192.22 g/mol. Its IUPAC name is (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide
PubChem CID104901521
Molecular FormulaC9H12N4O
Molecular Weight192.22 g/mol
Exact Mass192.10
IUPAC Name(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide
SMILESO=C(Nc1cccnn1)[C@H]1CCCN1
InChIInChI=1S/C9H12N4O/c14-9(7-3-1-5-10-7)12-8-4-2-6-11-13-8/h2,4,6-7,10H,1,3,5H2,(H,12,13,14)/t7-/m1/s1
InChIKeyCIRPZBRERXVLDZ-SSDOTTSWSA-N
XLogP0.17
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyridazin-3-ylazepane-2-carboxamide
CID 116786808
(2R)-N-pyridin-2-ylpyrrolidine-2-carboxamide
CID 103813190
N-(6-chloropyridazin-3-yl)pyrrolidine-2-carboxamide
CID 115626531
(2S)-N-(6-acetamido-2-pyridinyl)pyrrolidine-2-carboxamide
CID 102178535
(2S)-N-pyridin-2-ylpiperidine-2-carboxamide
CID 103813189
[4-(pyridazin-3-ylamino)piperidin-1-yl]-[(2S)-pyrrolidin-2-yl]methanone;dihydrochloride
CID 119879739
N-(6-chloro-2-pyridinyl)pyrrolidine-2-carboxamide
CID 79946508
(2S)-N-pyridin-3-ylpyrrolidine-2-carboxamide
CID 10607737
N-pyridin-4-ylpyrrolidine-2-carboxamide
CID 18072890
N-(1,2-oxazol-3-yl)pyrrolidine-2-carboxamide
CID 62902343
(2S)-N-(5-chloro-2-pyridinyl)pyrrolidine-2-carboxamide
CID 24749623
pyridazine-3-carboxamide;pyrrolidine-2-carboxylic acid
CID 161267101

Frequently Asked Questions

What is the IUPAC name of (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide?
The IUPAC name of (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide (CID 104901521) is (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide.
What is the SMILES notation for (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide?
The canonical SMILES for (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide is O=C(Nc1cccnn1)[C@H]1CCCN1.
What is the InChIKey of (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide?
The InChIKey is CIRPZBRERXVLDZ-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H12N4O/c14-9(7-3-1-5-10-7)12-8-4-2-6-11-13-8/h2,4,6-7,10H,1,3,5H2,(H,12,13,14)/t7-/m1/s1.
What are the key properties of (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide?
(2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide has a molecular weight of 192.22 g/mol, XLogP of 0.17, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-pyridazin-3-ylpyrrolidine-2-carboxamide is sourced from PubChem (CID 104901521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).