(3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine

C15H16N4O2 — CID 104733328

IUPAC(3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine
SMILESCCOc1cc(CN)ccc1Oc1nccn2nccc12
InChIInChI=1S/C15H16N4O2/c1-2-20-14-9-11(10-16)3-4-13(14)21-15-12-5-6-18-19(12)8-7-17-15/h3-9H,2,10,16H2,1H3
InChIKeyTUTLEGWZRZBUCI-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.38
Rot. Bonds5

About (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine

(3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine (PubChem CID 104733328) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine.

Molecular Properties

Compound Name(3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine
PubChem CID104733328
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name(3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine
SMILESCCOc1cc(CN)ccc1Oc1nccn2nccc12
InChIInChI=1S/C15H16N4O2/c1-2-20-14-9-11(10-16)3-4-13(14)21-15-12-5-6-18-19(12)8-7-17-15/h3-9H,2,10,16H2,1H3
InChIKeyTUTLEGWZRZBUCI-UHFFFAOYSA-N
XLogP2.38
TPSA74.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(3-methoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanol
CID 107743880
[3-ethoxy-4-(2-pyrazol-1-ylethoxy)phenyl]methanamine
CID 61491518
[4-(2-ethoxyphenoxy)-3-fluorophenyl]methanamine
CID 28966043
[3-ethoxy-4-[(3-methyl-1,2,4-thiadiazol-5-yl)oxy]phenyl]methanamine
CID 65273643
[3-ethoxy-4-(2-methyl-6-phenylpyrimidin-4-yl)oxyphenyl]methanamine
CID 16643394
[3-ethoxy-4-[2-(1-methylpyrazol-4-yl)ethoxy]phenyl]methanamine
CID 102999274
[4-(2-butoxyethoxy)-3-ethoxyphenyl]methanamine
CID 61483340
[3-ethoxy-4-(3-pyrrolidin-1-ylpropoxy)phenyl]methanamine
CID 61493596
N-[[3-(aminomethyl)phenyl]methyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 104729869
3-[4-(aminomethyl)-2-methoxyphenoxy]-1-cyclopropylpyrazin-2-one
CID 62929043
[4-[(4-bromophenyl)methoxy]-3-ethoxyphenyl]methanamine
CID 60878481
N-methyl-2-pyrazolo[1,5-a]pyrazin-4-yloxyethanamine
CID 104733451

Frequently Asked Questions

What is the IUPAC name of (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine?
The IUPAC name of (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine (CID 104733328) is (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine.
What is the SMILES notation for (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine?
The canonical SMILES for (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine is CCOc1cc(CN)ccc1Oc1nccn2nccc12.
What is the InChIKey of (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine?
The InChIKey is TUTLEGWZRZBUCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-2-20-14-9-11(10-16)3-4-13(14)21-15-12-5-6-18-19(12)8-7-17-15/h3-9H,2,10,16H2,1H3.
What are the key properties of (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine?
(3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine has a molecular weight of 284.32 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxy-4-pyrazolo[1,5-a]pyrazin-4-yloxyphenyl)methanamine is sourced from PubChem (CID 104733328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).