5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine

C13H16N4O — CID 171770243

IUPAC5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine
SMILESNc1ccc(-c2cnn(C3CCCCO3)c2)cn1
InChIInChI=1S/C13H16N4O/c14-12-5-4-10(7-15-12)11-8-16-17(9-11)13-3-1-2-6-18-13/h4-5,7-9,13H,1-3,6H2,(H2,14,15)
InChIKeyBZRJDAJJPCCJMJ-UHFFFAOYSA-N
MW244.30 g/mol
LogP2.23
Rot. Bonds2

About 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine

5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine (PubChem CID 171770243) has the molecular formula C13H16N4O and a molecular weight of 244.30 g/mol. Its IUPAC name is 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine
PubChem CID171770243
Molecular FormulaC13H16N4O
Molecular Weight244.30 g/mol
Exact Mass244.13
IUPAC Name5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine
SMILESNc1ccc(-c2cnn(C3CCCCO3)c2)cn1
InChIInChI=1S/C13H16N4O/c14-12-5-4-10(7-15-12)11-8-16-17(9-11)13-3-1-2-6-18-13/h4-5,7-9,13H,1-3,6H2,(H2,14,15)
InChIKeyBZRJDAJJPCCJMJ-UHFFFAOYSA-N
XLogP2.23
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-dimethyl-5-[1-[(2S)-oxan-2-yl]pyrazol-4-yl]pyridin-2-amine
CID 126430312
5-(1-cyclobutylpyrazol-4-yl)pyridin-2-amine
CID 162343137
5-[1-[(2S)-oxan-2-yl]pyrazol-4-yl]pyrimidine
CID 126433846
3-[4-[1-(oxan-2-yl)pyrazol-4-yl]phenyl]cyclobutan-1-amine
CID 167978748
4-[1-(oxan-2-yl)pyrazol-4-yl]phthalaldehyde
CID 162696460
[1-[4-[1-(oxan-2-yl)pyrazol-4-yl]phenyl]piperidin-4-yl]methanamine
CID 169094860
3-[1-(oxan-2-yl)pyrazol-4-yl]-5-(trifluoromethyl)aniline
CID 171392147
4-[2,5-difluoro-4-[1-(oxan-2-yl)pyrazol-4-yl]phenyl]-1-(oxan-2-yl)pyrazole
CID 140928225
2-fluoro-4-[1-(oxan-2-yl)pyrazol-4-yl]benzaldehyde
CID 176914480
3-[1-(oxan-2-yl)pyrazol-4-yl]pyridine-2-carboxamide
CID 142796783
3-deuterio-1-(oxan-2-yl)pyrazol-4-amine
CID 175855402
N-fluoro-2-methoxy-4-[1-(oxan-2-yl)pyrazol-4-yl]aniline
CID 156756104

Frequently Asked Questions

What is the IUPAC name of 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine?
The IUPAC name of 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine (CID 171770243) is 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine.
What is the SMILES notation for 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine?
The canonical SMILES for 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine is Nc1ccc(-c2cnn(C3CCCCO3)c2)cn1.
What is the InChIKey of 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine?
The InChIKey is BZRJDAJJPCCJMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O/c14-12-5-4-10(7-15-12)11-8-16-17(9-11)13-3-1-2-6-18-13/h4-5,7-9,13H,1-3,6H2,(H2,14,15).
What are the key properties of 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine?
5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine has a molecular weight of 244.30 g/mol, XLogP of 2.23, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(oxan-2-yl)pyrazol-4-yl]pyridin-2-amine is sourced from PubChem (CID 171770243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).