2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine

C19H19N5 — CID 11244033

IUPAC2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine
SMILESCC(C)(N)c1ccc(-c2ccc3[nH]ncc3c2-c2ccn[nH]2)cc1
InChIInChI=1S/C19H19N5/c1-19(2,20)13-5-3-12(4-6-13)14-7-8-16-15(11-22-23-16)18(14)17-9-10-21-24-17/h3-11H,20H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyGADPNHKLBDOTFC-UHFFFAOYSA-N
MW317.40 g/mol
LogP3.81
Rot. Bonds3

About 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine

2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine (PubChem CID 11244033) has the molecular formula C19H19N5 and a molecular weight of 317.40 g/mol. Its IUPAC name is 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine.

Molecular Properties

Compound Name2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine
PubChem CID11244033
Molecular FormulaC19H19N5
Molecular Weight317.40 g/mol
Exact Mass317.16
IUPAC Name2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine
SMILESCC(C)(N)c1ccc(-c2ccc3[nH]ncc3c2-c2ccn[nH]2)cc1
InChIInChI=1S/C19H19N5/c1-19(2,20)13-5-3-12(4-6-13)14-7-8-16-15(11-22-23-16)18(14)17-9-10-21-24-17/h3-11H,20H2,1-2H3,(H,21,24)(H,22,23)
InChIKeyGADPNHKLBDOTFC-UHFFFAOYSA-N
XLogP3.81
TPSA83.38 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.40
LogP ≤ 53.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine 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-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine?
The IUPAC name of 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine (CID 11244033) is 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine.
What is the SMILES notation for 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine?
The canonical SMILES for 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine is CC(C)(N)c1ccc(-c2ccc3[nH]ncc3c2-c2ccn[nH]2)cc1.
What is the InChIKey of 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine?
The InChIKey is GADPNHKLBDOTFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5/c1-19(2,20)13-5-3-12(4-6-13)14-7-8-16-15(11-22-23-16)18(14)17-9-10-21-24-17/h3-11H,20H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine?
2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine has a molecular weight of 317.40 g/mol, XLogP of 3.81, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-(1H-pyrazol-5-yl)-1H-indazol-5-yl]phenyl]propan-2-amine is sourced from PubChem (CID 11244033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).