2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine

C14H21N5O — CID 104734336

IUPAC2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine
SMILESCc1cc2c(N3CCC(OCCN)CC3)nccn2n1
InChIInChI=1S/C14H21N5O/c1-11-10-13-14(16-5-8-19(13)17-11)18-6-2-12(3-7-18)20-9-4-15/h5,8,10,12H,2-4,6-7,9,15H2,1H3
InChIKeyATACROQZGHHQIO-UHFFFAOYSA-N
MW275.36 g/mol
LogP0.98
Rot. Bonds4

About 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine

2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine (PubChem CID 104734336) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine.

Molecular Properties

Compound Name2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine
PubChem CID104734336
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine
SMILESCc1cc2c(N3CCC(OCCN)CC3)nccn2n1
InChIInChI=1S/C14H21N5O/c1-11-10-13-14(16-5-8-19(13)17-11)18-6-2-12(3-7-18)20-9-4-15/h5,8,10,12H,2-4,6-7,9,15H2,1H3
InChIKeyATACROQZGHHQIO-UHFFFAOYSA-N
XLogP0.98
TPSA68.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidine-4-carboxylate
CID 104733371
N-[[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]methyl]propan-2-amine
CID 104733601
3-[4-(2-aminoethoxy)piperidin-1-yl]-1-methylpyrazin-2-one
CID 82692612
4-(3-chloropyrrolidin-1-yl)-2-methylpyrazolo[1,5-a]pyrazine
CID 104733876
1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-one
CID 104730047
4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)morpholine
CID 133487949
4-N,4-N-dimethyl-6-N-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126888492
4-[4-(3-chloro-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 133490284
2-methyl-4-(3-pyrazol-1-ylpyrrolidin-1-yl)pyrazolo[1,5-a]pyrazine
CID 126946467
4-N-cyclopropyl-6-N,6-N-dimethyl-4-N-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]pyrimidine-4,6-diamine
CID 126891497
4-[4-(3-bromo-2-pyridinyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 166601620
N-cyclopropyl-2-[4-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperazin-1-yl]acetamide
CID 133488688

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine?
The IUPAC name of 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine (CID 104734336) is 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine.
What is the SMILES notation for 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine?
The canonical SMILES for 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine is Cc1cc2c(N3CCC(OCCN)CC3)nccn2n1.
What is the InChIKey of 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine?
The InChIKey is ATACROQZGHHQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O/c1-11-10-13-14(16-5-8-19(13)17-11)18-6-2-12(3-7-18)20-9-4-15/h5,8,10,12H,2-4,6-7,9,15H2,1H3.
What are the key properties of 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine?
2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine has a molecular weight of 275.36 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylpyrazolo[1,5-a]pyrazin-4-yl)piperidin-4-yl]oxyethanamine is sourced from PubChem (CID 104734336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).