naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine

C17H14N4 — CID 103126924

IUPACnaphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine
SMILESNC(c1cccc2ccccc12)c1cnn2ccncc12
InChIInChI=1S/C17H14N4/c18-17(15-10-20-21-9-8-19-11-16(15)21)14-7-3-5-12-4-1-2-6-13(12)14/h1-11,17H,18H2
InChIKeyZPBLXQVPAGRROB-UHFFFAOYSA-N
MW274.33 g/mol
LogP2.93
Rot. Bonds2

About naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine

naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine (PubChem CID 103126924) has the molecular formula C17H14N4 and a molecular weight of 274.33 g/mol. Its IUPAC name is naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine.

Molecular Properties

Compound Namenaphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine
PubChem CID103126924
Molecular FormulaC17H14N4
Molecular Weight274.33 g/mol
Exact Mass274.12
IUPAC Namenaphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine
SMILESNC(c1cccc2ccccc12)c1cnn2ccncc12
InChIInChI=1S/C17H14N4/c18-17(15-10-20-21-9-8-19-11-16(15)21)14-7-3-5-12-4-1-2-6-13(12)14/h1-11,17H,18H2
InChIKeyZPBLXQVPAGRROB-UHFFFAOYSA-N
XLogP2.93
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-chlorophenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanamine
CID 103126268
(4-methoxyphenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethanamine
CID 103126217
1-pyrazolo[1,5-a]pyrazin-3-yl-2-pyridin-2-ylethanamine
CID 103127478
(5-fluoro-1-benzofuran-2-yl)-pyrazolo[1,5-a]pyrazin-3-ylmethanamine
CID 103128255
1-pyrazolo[1,5-a]pyrazin-3-ylpropan-1-amine
CID 103125780
pyrazolo[1,5-a]pyrazin-3-yl(quinolin-5-yl)methanol
CID 103129095
1-benzofuran-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanol
CID 103129234
2-(2,6-difluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103129309
2-(2,6-dimethylphenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103129126
2-(2-chloro-6-fluorophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanamine
CID 103126337
2-(2-bromophenyl)-1-pyrazolo[1,5-a]pyrazin-3-ylethanol
CID 103128491
N-[(2-chlorophenyl)-pyrazolo[1,5-a]pyrazin-3-ylmethyl]propan-1-amine
CID 103126263

Frequently Asked Questions

What is the IUPAC name of naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
The IUPAC name of naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine (CID 103126924) is naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine.
What is the SMILES notation for naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
The canonical SMILES for naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine is NC(c1cccc2ccccc12)c1cnn2ccncc12.
What is the InChIKey of naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
The InChIKey is ZPBLXQVPAGRROB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4/c18-17(15-10-20-21-9-8-19-11-16(15)21)14-7-3-5-12-4-1-2-6-13(12)14/h1-11,17H,18H2.
What are the key properties of naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine?
naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine has a molecular weight of 274.33 g/mol, XLogP of 2.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine is sourced from PubChem (CID 103126924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).