N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide

C19H15N5O3 — CID 4687747

IUPACN-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)/N=N/c2c(O)[nH]c3ccccc23)[nH]n1
InChIInChI=1S/C19H15N5O3/c1-27-16-9-5-3-6-11(16)14-10-15(22-21-14)18(25)24-23-17-12-7-2-4-8-13(12)20-19(17)26/h2-10,20,26H,1H3,(H,21,22)/b24-23+
InChIKeyCZLAIOWGHWBMPI-WCWDXBQESA-N
MW361.36 g/mol
LogP4.20
Rot. Bonds4

About N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide

N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide (PubChem CID 4687747) has the molecular formula C19H15N5O3 and a molecular weight of 361.36 g/mol. Its IUPAC name is N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound NameN-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
PubChem CID4687747
Molecular FormulaC19H15N5O3
Molecular Weight361.36 g/mol
Exact Mass361.12
IUPAC NameN-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
SMILESCOc1ccccc1-c1cc(C(=O)/N=N/c2c(O)[nH]c3ccccc23)[nH]n1
InChIInChI=1S/C19H15N5O3/c1-27-16-9-5-3-6-11(16)14-10-15(22-21-14)18(25)24-23-17-12-7-2-4-8-13(12)20-19(17)26/h2-10,20,26H,1H3,(H,21,22)/b24-23+
InChIKeyCZLAIOWGHWBMPI-WCWDXBQESA-N
XLogP4.20
TPSA115.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.36
LogP ≤ 54.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide 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 N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide (CID 4687747) is N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide is COc1ccccc1-c1cc(C(=O)/N=N/c2c(O)[nH]c3ccccc23)[nH]n1.
What is the InChIKey of N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide?
The InChIKey is CZLAIOWGHWBMPI-WCWDXBQESA-N. The full InChI is InChI=1S/C19H15N5O3/c1-27-16-9-5-3-6-11(16)14-10-15(22-21-14)18(25)24-23-17-12-7-2-4-8-13(12)20-19(17)26/h2-10,20,26H,1H3,(H,21,22)/b24-23+.
What are the key properties of N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide?
N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide has a molecular weight of 361.36 g/mol, XLogP of 4.20, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-hydroxy-1H-indol-3-yl)imino]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 4687747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).