2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol

C17H22N4O — CID 117210810

IUPAC2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol
SMILESNC1CCN(c2cnn(-c3ccccc3O)c2C2CC2)CC1
InChIInChI=1S/C17H22N4O/c18-13-7-9-20(10-8-13)15-11-19-21(17(15)12-5-6-12)14-3-1-2-4-16(14)22/h1-4,11-13,22H,5-10,18H2
InChIKeyOJBFGLMDHZSMFA-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.38
Rot. Bonds3

About 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol

2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol (PubChem CID 117210810) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol.

Molecular Properties

Compound Name2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol
PubChem CID117210810
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC Name2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol
SMILESNC1CCN(c2cnn(-c3ccccc3O)c2C2CC2)CC1
InChIInChI=1S/C17H22N4O/c18-13-7-9-20(10-8-13)15-11-19-21(17(15)12-5-6-12)14-3-1-2-4-16(14)22/h1-4,11-13,22H,5-10,18H2
InChIKeyOJBFGLMDHZSMFA-UHFFFAOYSA-N
XLogP2.38
TPSA67.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol?
The IUPAC name of 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol (CID 117210810) is 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol.
What is the SMILES notation for 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol?
The canonical SMILES for 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol is NC1CCN(c2cnn(-c3ccccc3O)c2C2CC2)CC1.
What is the InChIKey of 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol?
The InChIKey is OJBFGLMDHZSMFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c18-13-7-9-20(10-8-13)15-11-19-21(17(15)12-5-6-12)14-3-1-2-4-16(14)22/h1-4,11-13,22H,5-10,18H2.
What are the key properties of 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol?
2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol has a molecular weight of 298.39 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-aminopiperidin-1-yl)-5-cyclopropylpyrazol-1-yl]phenol is sourced from PubChem (CID 117210810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).