3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide

C20H19N5O2 — CID 153235048

IUPAC3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESNC(=O)c1c(CCc2ccc(O)cc2)n[nH]c1Cc1ccc2[nH]ncc2c1
InChIInChI=1S/C20H19N5O2/c21-20(27)19-17(8-3-12-1-5-15(26)6-2-12)24-25-18(19)10-13-4-7-16-14(9-13)11-22-23-16/h1-2,4-7,9,11,26H,3,8,10H2,(H2,21,27)(H,22,23)(H,24,25)
InChIKeyWQHYUMJKAKXUJK-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.47
Rot. Bonds6

About 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide

3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide (PubChem CID 153235048) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide
PubChem CID153235048
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC Name3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide
SMILESNC(=O)c1c(CCc2ccc(O)cc2)n[nH]c1Cc1ccc2[nH]ncc2c1
InChIInChI=1S/C20H19N5O2/c21-20(27)19-17(8-3-12-1-5-15(26)6-2-12)24-25-18(19)10-13-4-7-16-14(9-13)11-22-23-16/h1-2,4-7,9,11,26H,3,8,10H2,(H2,21,27)(H,22,23)(H,24,25)
InChIKeyWQHYUMJKAKXUJK-UHFFFAOYSA-N
XLogP2.47
TPSA120.68 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.47
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-[(4-acetylphenyl)methyl]-3-[2-(4-hydroxyphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 149337308
5-[(4-tert-butylphenyl)methyl]-3-[2-(4-methylphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 157414994
5-[(3-chlorophenyl)methyl]-3-[2-(4-hydroxy-3,5-dimethylphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 160822484
5-[(3-chlorophenyl)methyl]-3-(3-phenylpropyl)-1H-pyrazole-4-carboxamide
CID 158216481
2-(1H-indazol-5-yl)acetic acid
CID 39103838
2-(4-hydroxyphenyl)-N-(1H-indazol-5-yl)acetamide
CID 23570801
5-[[4-[[4-(hydroxymethyl)benzoyl]amino]phenyl]methyl]-3-[2-(4-methylphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 159243762
1H-indazol-5-ylmethyl 1-methylcyclopropane-1-carboxylate
CID 167800300
2-chloro-N-[2-(1H-indazol-5-yl)ethyl]acetamide
CID 154880645
5-(methoxymethyl)-1H-indazole
CID 123206066
7-(1H-indazol-5-ylmethyl)-2H-triazolo[4,5-b]pyridin-5-amine
CID 126679445
5-(chloromethyl)-1H-indazole;hydrochloride
CID 72710304

Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide?
The IUPAC name of 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide (CID 153235048) is 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide?
The canonical SMILES for 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide is NC(=O)c1c(CCc2ccc(O)cc2)n[nH]c1Cc1ccc2[nH]ncc2c1.
What is the InChIKey of 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide?
The InChIKey is WQHYUMJKAKXUJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c21-20(27)19-17(8-3-12-1-5-15(26)6-2-12)24-25-18(19)10-13-4-7-16-14(9-13)11-22-23-16/h1-2,4-7,9,11,26H,3,8,10H2,(H2,21,27)(H,22,23)(H,24,25).
What are the key properties of 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide?
3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide has a molecular weight of 361.41 g/mol, XLogP of 2.47, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-hydroxyphenyl)ethyl]-5-(1H-indazol-5-ylmethyl)-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 153235048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).