5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine

C12H14N4O — CID 114196136

IUPAC5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine
SMILESNc1n[nH]c(C2CCOC2)c1-c1ccccn1
InChIInChI=1S/C12H14N4O/c13-12-10(9-3-1-2-5-14-9)11(15-16-12)8-4-6-17-7-8/h1-3,5,8H,4,6-7H2,(H3,13,15,16)
InChIKeyCHJXGVSVHLHQHY-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.56
Rot. Bonds2

About 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine

5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine (PubChem CID 114196136) has the molecular formula C12H14N4O and a molecular weight of 230.27 g/mol. Its IUPAC name is 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine
PubChem CID114196136
Molecular FormulaC12H14N4O
Molecular Weight230.27 g/mol
Exact Mass230.12
IUPAC Name5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine
SMILESNc1n[nH]c(C2CCOC2)c1-c1ccccn1
InChIInChI=1S/C12H14N4O/c13-12-10(9-3-1-2-5-14-9)11(15-16-12)8-4-6-17-7-8/h1-3,5,8H,4,6-7H2,(H3,13,15,16)
InChIKeyCHJXGVSVHLHQHY-UHFFFAOYSA-N
XLogP1.56
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(oxan-4-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine
CID 80521268
5-cyclopropyl-4-pyridin-2-yl-1H-pyrazol-3-amine
CID 80521158
5-(oxan-3-yl)-4-pyridin-3-yl-1H-pyrazol-3-amine
CID 80522931
4-(4-fluorophenyl)-5-(oxan-4-yl)-1H-pyrazol-3-amine
CID 62907249
5-(cyclopropylmethyl)-4-pyridin-2-yl-1H-pyrazol-3-amine
CID 80521154
4-(2,4-difluorophenyl)-5-(oxan-3-yl)-1H-pyrazol-3-amine
CID 64559125
4-(4-methoxyphenyl)-5-(oxan-4-yl)-1H-pyrazol-3-amine
CID 62907421
4-(3,4-dimethylphenyl)-5-(oxan-4-yl)-1H-pyrazol-3-amine
CID 62900164
5-propan-2-yl-4-pyridin-2-yl-1H-pyrazol-3-amine
CID 80521332
4-(5-chloro-2-methoxyphenyl)-5-(oxan-3-yl)-1H-pyrazol-3-amine
CID 63013480
5-(1,3-dihydro-2-benzofuran-5-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine
CID 80519875
2-(oxolan-3-yl)-1,5-naphthyridin-3-amine
CID 169088323

Frequently Asked Questions

What is the IUPAC name of 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
The IUPAC name of 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine (CID 114196136) is 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
The canonical SMILES for 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine is Nc1n[nH]c(C2CCOC2)c1-c1ccccn1.
What is the InChIKey of 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
The InChIKey is CHJXGVSVHLHQHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O/c13-12-10(9-3-1-2-5-14-9)11(15-16-12)8-4-6-17-7-8/h1-3,5,8H,4,6-7H2,(H3,13,15,16).
What are the key properties of 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine?
5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine has a molecular weight of 230.27 g/mol, XLogP of 1.56, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxolan-3-yl)-4-pyridin-2-yl-1H-pyrazol-3-amine is sourced from PubChem (CID 114196136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).