3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine

C18H18N6O — CID 139331390

IUPAC3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine
SMILESCc1onc(-c2nn(C(C)C)c3ccnc(N)c23)c1-c1ccccn1
InChIInChI=1S/C18H18N6O/c1-10(2)24-13-7-9-21-18(19)15(13)16(22-24)17-14(11(3)25-23-17)12-6-4-5-8-20-12/h4-10H,1-3H3,(H2,19,21)
InChIKeyBRTMAGRKDCWGEW-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.62
Rot. Bonds3

About 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine

3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine (PubChem CID 139331390) has the molecular formula C18H18N6O and a molecular weight of 334.38 g/mol. Its IUPAC name is 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine.

Molecular Properties

Compound Name3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine
PubChem CID139331390
Molecular FormulaC18H18N6O
Molecular Weight334.38 g/mol
Exact Mass334.15
IUPAC Name3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine
SMILESCc1onc(-c2nn(C(C)C)c3ccnc(N)c23)c1-c1ccccn1
InChIInChI=1S/C18H18N6O/c1-10(2)24-13-7-9-21-18(19)15(13)16(22-24)17-14(11(3)25-23-17)12-6-4-5-8-20-12/h4-10H,1-3H3,(H2,19,21)
InChIKeyBRTMAGRKDCWGEW-UHFFFAOYSA-N
XLogP3.62
TPSA95.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine?
The IUPAC name of 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine (CID 139331390) is 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine.
What is the SMILES notation for 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine?
The canonical SMILES for 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine is Cc1onc(-c2nn(C(C)C)c3ccnc(N)c23)c1-c1ccccn1.
What is the InChIKey of 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine?
The InChIKey is BRTMAGRKDCWGEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6O/c1-10(2)24-13-7-9-21-18(19)15(13)16(22-24)17-14(11(3)25-23-17)12-6-4-5-8-20-12/h4-10H,1-3H3,(H2,19,21).
What are the key properties of 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine?
3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine has a molecular weight of 334.38 g/mol, XLogP of 3.62, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-4-pyridin-2-yl-1,2-oxazol-3-yl)-1-propan-2-ylpyrazolo[4,3-c]pyridin-4-amine is sourced from PubChem (CID 139331390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).