(4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone

C9H14N4O2 — CID 65359274

IUPAC(4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone
SMILESCn1ncc(N)c1C(=O)N1CCC(O)C1
InChIInChI=1S/C9H14N4O2/c1-12-8(7(10)4-11-12)9(15)13-3-2-6(14)5-13/h4,6,14H,2-3,5,10H2,1H3
InChIKeyZKWRDESQZOBQCZ-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.79
Rot. Bonds1

About (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone

(4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone (PubChem CID 65359274) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone.

Molecular Properties

Compound Name(4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone
PubChem CID65359274
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name(4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone
SMILESCn1ncc(N)c1C(=O)N1CCC(O)C1
InChIInChI=1S/C9H14N4O2/c1-12-8(7(10)4-11-12)9(15)13-3-2-6(14)5-13/h4,6,14H,2-3,5,10H2,1H3
InChIKeyZKWRDESQZOBQCZ-UHFFFAOYSA-N
XLogP-0.79
TPSA84.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(4-amino-1-ethylpyrazol-5-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 107209796
4-(3-hydroxypyrrolidine-1-carbonyl)-1-methylpyrazole-5-carboxylic acid
CID 67041580
(4-amino-1-methylpyrazol-5-yl)-(4-ethylpiperidin-1-yl)methanone
CID 65359976
(4-amino-1-methylpyrazol-5-yl)-(4-methylsulfanylpiperidin-1-yl)methanone
CID 114236470
(4-amino-1-methylpyrazol-5-yl)-[3-(trifluoromethyl)piperidin-1-yl]methanone
CID 65356023
2-(4-amino-1-methylpyrazole-5-carbonyl)-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 82857155
(4-amino-1-methylpyrazol-5-yl)-(4-ethyl-3-methylpiperazin-1-yl)methanone
CID 65359569
N-[1-(4-amino-1-methylpyrazole-5-carbonyl)piperidin-4-yl]ethanesulfonamide
CID 65359684
(4-amino-1-methylpyrazol-5-yl)-[4-[[methyl(propan-2-yl)amino]methyl]piperidin-1-yl]methanone
CID 65359734
(4-amino-1-methylpyrazol-5-yl)-(4-propylpiperazin-1-yl)methanone
CID 65355801
(4-amino-1-methylpyrazol-3-yl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 107209806
(4-amino-1-methylpyrazol-5-yl)-[(2S,6R)-2,6-dimethylpiperidin-1-yl]methanone
CID 104966891

Frequently Asked Questions

What is the IUPAC name of (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone?
The IUPAC name of (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone (CID 65359274) is (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone.
What is the SMILES notation for (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone?
The canonical SMILES for (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone is Cn1ncc(N)c1C(=O)N1CCC(O)C1.
What is the InChIKey of (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone?
The InChIKey is ZKWRDESQZOBQCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-12-8(7(10)4-11-12)9(15)13-3-2-6(14)5-13/h4,6,14H,2-3,5,10H2,1H3.
What are the key properties of (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone?
(4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone has a molecular weight of 210.24 g/mol, XLogP of -0.79, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-1-methylpyrazol-5-yl)-(3-hydroxypyrrolidin-1-yl)methanone is sourced from PubChem (CID 65359274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).