5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole

C9H10N4O — CID 130950606

IUPAC5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole
SMILESc1ncc(-c2n[nH]c3c2CNCC3)o1
InChIInChI=1S/C9H10N4O/c1-2-10-3-6-7(1)12-13-9(6)8-4-11-5-14-8/h4-5,10H,1-3H2,(H,12,13)
InChIKeyPMHPEPLHJOHRMH-UHFFFAOYSA-N
MW190.21 g/mol
LogP0.71
Rot. Bonds1

About 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole

5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole (PubChem CID 130950606) has the molecular formula C9H10N4O and a molecular weight of 190.21 g/mol. Its IUPAC name is 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole.

Molecular Properties

Compound Name5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole
PubChem CID130950606
Molecular FormulaC9H10N4O
Molecular Weight190.21 g/mol
Exact Mass190.09
IUPAC Name5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole
SMILESc1ncc(-c2n[nH]c3c2CNCC3)o1
InChIInChI=1S/C9H10N4O/c1-2-10-3-6-7(1)12-13-9(6)8-4-11-5-14-8/h4-5,10H,1-3H2,(H,12,13)
InChIKeyPMHPEPLHJOHRMH-UHFFFAOYSA-N
XLogP0.71
TPSA66.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.21
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3,5-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 82301056
4-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)benzoic acid
CID 110540362
3-(4-methylsulfanylphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 57140925
3-(2,3,4-trifluorophenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 82588751
3-(oxan-4-yl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 82395612
3-(2-chloro-3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 110538918
3-(3-bromo-4-methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 110538216
2-nitro-4-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)phenol
CID 136822369
3-(3,5-dichloro-4-propoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 110537326
3-cyclobutyl-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 84647048
4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine-3-carboxamide;hydrochloride
CID 56832020
3-[6-(4,5,6,7-tetrahydro-1H-indazol-3-yl)pyrazin-2-yl]-4,5,6,7-tetrahydro-1H-indazole
CID 156661602

Frequently Asked Questions

What is the IUPAC name of 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole?
The IUPAC name of 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole (CID 130950606) is 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole.
What is the SMILES notation for 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole?
The canonical SMILES for 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole is c1ncc(-c2n[nH]c3c2CNCC3)o1.
What is the InChIKey of 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole?
The InChIKey is PMHPEPLHJOHRMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O/c1-2-10-3-6-7(1)12-13-9(6)8-4-11-5-14-8/h4-5,10H,1-3H2,(H,12,13).
What are the key properties of 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole?
5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole has a molecular weight of 190.21 g/mol, XLogP of 0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridin-3-yl)-1,3-oxazole is sourced from PubChem (CID 130950606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).