1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde

C12H14N4O — CID 104733726

IUPAC1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde
SMILESO=CC1CCCCN1c1nccn2nccc12
InChIInChI=1S/C12H14N4O/c17-9-10-3-1-2-7-15(10)12-11-4-5-14-16(11)8-6-13-12/h4-6,8-10H,1-3,7H2
InChIKeyGHSZLXZMBKQIDL-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.29
Rot. Bonds2

About 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde

1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde (PubChem CID 104733726) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde.

Molecular Properties

Compound Name1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde
PubChem CID104733726
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde
SMILESO=CC1CCCCN1c1nccn2nccc12
InChIInChI=1S/C12H14N4O/c17-9-10-3-1-2-7-15(10)12-11-4-5-14-16(11)8-6-13-12/h4-6,8-10H,1-3,7H2
InChIKeyGHSZLXZMBKQIDL-UHFFFAOYSA-N
XLogP1.29
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-2-yl)acetic acid
CID 104729407
2-(2-formylpiperidin-1-yl)pyridine-3-carbonitrile
CID 62663072
2-methyl-N-[(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-2-yl)methyl]propan-2-amine
CID 104733642
N-ethyl-1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-2-yl)ethanamine
CID 104729255
1-furo[3,2-c]pyridin-4-ylpiperidine-2-carbaldehyde
CID 106535618
4-[2-(3-bromopropyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrazine
CID 113446660
methyl 1-pyrazolo[1,5-a]pyrazin-4-ylpyrrolidine-2-carboxylate
CID 113446554
1-pyridin-2-ylpiperidine-2-carbaldehyde
CID 62665226
1-(5-methoxyisoquinolin-1-yl)piperidine-2-carbaldehyde
CID 106542383
1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-4-yl)ethanone
CID 104730056
1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-3-carboxamide
CID 172899821
1-(1-pyrazolo[1,5-a]pyrazin-4-ylpiperidin-3-yl)ethanone
CID 113446199

Frequently Asked Questions

What is the IUPAC name of 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde?
The IUPAC name of 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde (CID 104733726) is 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde.
What is the SMILES notation for 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde?
The canonical SMILES for 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde is O=CC1CCCCN1c1nccn2nccc12.
What is the InChIKey of 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde?
The InChIKey is GHSZLXZMBKQIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c17-9-10-3-1-2-7-15(10)12-11-4-5-14-16(11)8-6-13-12/h4-6,8-10H,1-3,7H2.
What are the key properties of 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde?
1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde has a molecular weight of 230.27 g/mol, XLogP of 1.29, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazolo[1,5-a]pyrazin-4-ylpiperidine-2-carbaldehyde is sourced from PubChem (CID 104733726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).