(4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone

C12H19N5O2 — CID 63168261

IUPAC(4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
SMILESNc1cn[nH]c1C(=O)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C12H19N5O2/c13-10-7-14-15-11(10)12(18)17-2-1-9(8-17)16-3-5-19-6-4-16/h7,9H,1-6,8,13H2,(H,14,15)
InChIKeyLKQPHZILOQGFSG-UHFFFAOYSA-N
MW265.32 g/mol
LogP-0.46
Rot. Bonds2

About (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone

(4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone (PubChem CID 63168261) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
PubChem CID63168261
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name(4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
SMILESNc1cn[nH]c1C(=O)N1CCC(N2CCOCC2)C1
InChIInChI=1S/C12H19N5O2/c13-10-7-14-15-11(10)12(18)17-2-1-9(8-17)16-3-5-19-6-4-16/h7,9H,1-6,8,13H2,(H,14,15)
InChIKeyLKQPHZILOQGFSG-UHFFFAOYSA-N
XLogP-0.46
TPSA87.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(4-amino-1H-pyrazol-5-yl)-(3-pyrrolidin-1-ylpiperidin-1-yl)methanone
CID 63102325
(3-morpholin-4-ylpyrrolidin-1-yl)-(1H-pyrazol-4-yl)methanone
CID 63174828
(4-amino-1H-pyrazol-5-yl)-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102954850
(2-aminophenyl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone;dihydrochloride
CID 119946729
(4-amino-1H-pyrazol-5-yl)-[3-(1-hydroxyethyl)pyrrolidin-1-yl]methanone
CID 112623776
(4-amino-3-hydroxyphenyl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
CID 107075249
[5-[(3S)-oxolan-3-yl]-1H-pyrazol-4-yl]-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]methanone
CID 129337050
[5-[(3R)-oxolan-3-yl]-1H-pyrazol-4-yl]-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]methanone
CID 129337051
(4-nitro-1H-pyrazol-5-yl)-(3-piperazin-1-ylpyrrolidin-1-yl)methanone
CID 120994785
(5-amino-2-methylphenyl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
CID 63168260
(5-amino-2-fluorophenyl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone
CID 63167995
(4-amino-1H-pyrazol-5-yl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 63103256

Frequently Asked Questions

What is the IUPAC name of (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone?
The IUPAC name of (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone (CID 63168261) is (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone.
What is the SMILES notation for (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone?
The canonical SMILES for (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone is Nc1cn[nH]c1C(=O)N1CCC(N2CCOCC2)C1.
What is the InChIKey of (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone?
The InChIKey is LKQPHZILOQGFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c13-10-7-14-15-11(10)12(18)17-2-1-9(8-17)16-3-5-19-6-4-16/h7,9H,1-6,8,13H2,(H,14,15).
What are the key properties of (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone?
(4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone has a molecular weight of 265.32 g/mol, XLogP of -0.46, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-1H-pyrazol-5-yl)-(3-morpholin-4-ylpyrrolidin-1-yl)methanone is sourced from PubChem (CID 63168261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).