oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine

C13H17N3O — CID 107138761

IUPACoxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine
SMILESNC(c1cnn2ccccc12)C1CCCOC1
InChIInChI=1S/C13H17N3O/c14-13(10-4-3-7-17-9-10)11-8-15-16-6-2-1-5-12(11)16/h1-2,5-6,8,10,13H,3-4,7,9,14H2
InChIKeyOKCHMOTVFWJJFZ-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.76
Rot. Bonds2

About oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine

oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine (PubChem CID 107138761) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine.

Molecular Properties

Compound Nameoxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine
PubChem CID107138761
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Nameoxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine
SMILESNC(c1cnn2ccccc12)C1CCCOC1
InChIInChI=1S/C13H17N3O/c14-13(10-4-3-7-17-9-10)11-8-15-16-6-2-1-5-12(11)16/h1-2,5-6,8,10,13H,3-4,7,9,14H2
InChIKeyOKCHMOTVFWJJFZ-UHFFFAOYSA-N
XLogP1.76
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

oxolan-3-yl(pyrazolo[1,5-a]pyrazin-3-yl)methanamine
CID 103127122
isoquinolin-4-yl(oxan-3-yl)methanamine
CID 65331748
(2-methoxyphenyl)-(oxan-3-yl)methanamine
CID 65331854
[oxan-3-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]hydrazine
CID 107139918
3-cyclopropyl-1-pyrazolo[1,5-a]pyridin-3-ylpropan-1-amine
CID 103127469
(2-cyclohexyl-1-pyrazolo[1,5-a]pyridin-3-ylethyl)hydrazine
CID 103129550
1H-indol-3-yl(oxan-3-yl)methanamine
CID 112742639
phenyl(pyrazolo[1,5-a]pyridin-3-yl)methanamine
CID 103125948
N-methyl-1-(3-methylcyclohexyl)-1-pyrazolo[1,5-a]pyridin-3-ylmethanamine
CID 103127395
(3-bromo-2-methylphenyl)-(oxan-3-yl)methanamine
CID 107139205
4-(oxan-3-ylamino)pyrrolo[1,2-b]pyridazine-3-carbonitrile
CID 50914176
(1-ethylpyrazol-4-yl)-(oxan-3-yl)methanamine
CID 65332290

Frequently Asked Questions

What is the IUPAC name of oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine?
The IUPAC name of oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine (CID 107138761) is oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine.
What is the SMILES notation for oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine?
The canonical SMILES for oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine is NC(c1cnn2ccccc12)C1CCCOC1.
What is the InChIKey of oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine?
The InChIKey is OKCHMOTVFWJJFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c14-13(10-4-3-7-17-9-10)11-8-15-16-6-2-1-5-12(11)16/h1-2,5-6,8,10,13H,3-4,7,9,14H2.
What are the key properties of oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine?
oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine has a molecular weight of 231.30 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxan-3-yl(pyrazolo[1,5-a]pyridin-3-yl)methanamine is sourced from PubChem (CID 107138761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).