Skip to content

Acoramidis

C15H17FN2O3 — CID 71464713

💊View drug profile → acoramidis

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid
SMILESCc1n[nH]c(C)c1CCCOc1cc(C(=O)O)ccc1F
InChIInChI=1S/C15H17FN2O3/c1-9-12(10(2)18-17-9)4-3-7-21-14-8-11(15(19)20)5-6-13(14)16/h5-6,8H,3-4,7H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyWBFUHHBPNXWNCC-UHFFFAOYSA-N
MW292.31 g/mol
LogP2.88
Rot. Bonds6

About Acoramidis

Acoramidis (PubChem CID 71464713) has the molecular formula C15H17FN2O3 and a molecular weight of 292.31 g/mol. Its IUPAC name is 3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid.

Molecular Properties

Compound NameAcoramidis
PubChem CID71464713
Molecular FormulaC15H17FN2O3
Molecular Weight292.31 g/mol
Exact Mass292.12
IUPAC Name3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid
SMILESCc1n[nH]c(C)c1CCCOc1cc(C(=O)O)ccc1F
InChIInChI=1S/C15H17FN2O3/c1-9-12(10(2)18-17-9)4-3-7-21-14-8-11(15(19)20)5-6-13(14)16/h5-6,8H,3-4,7H2,1-2H3,(H,17,18)(H,19,20)
InChIKeyWBFUHHBPNXWNCC-UHFFFAOYSA-N
XLogP2.88
TPSA75.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.31
LogP ≤ 52.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze Acoramidis 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

3-(3-methoxyphenyl)-1H-pyrazole-5-carboxylic acid
CID 1399024
3-(3-(3,5-Dimethyl-1H-pyrazol-4-yl)-propoxy)-4-fluoro-benzoic acid methyl ester
CID 90235879
3-(4-Methoxyphenyl)-1H-pyrazole-5-carboxylic acid
CID 1085887
5-(4-ethoxyphenyl)-1H-pyrazole-3-carboxylic acid
CID 3159737
3-(2,5-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid
CID 3161252
Acoramidis Hydrochloride
CID 135307127
methyl 3-(4-ethoxyphenyl)-1H-pyrazole-5-carboxylate
CID 2042513
5-Methyl-4-(4-phenoxybenzyl)-1H-pyrazole-3-carboxylic acid
CID 71455286
3-(3-(3,5-Dimethyl-1H-pyrazol-4-yl)propoxy)-4-iodobenzoic acid
CID 139507733
4-Fluoro-3-(3-(1,3,5-trimethyl-1H-pyrazol-4-yl)propoxy)benzoic acid
CID 139507742
methyl 3-(4-butoxyphenyl)-1H-pyrazole-5-carboxylate
CID 16654604
5-methyl-4-[(3-phenoxyphenyl)methyl]-1H-pyrazole-3-carboxylic acid
CID 71457069

Frequently Asked Questions

What is the IUPAC name of Acoramidis?
The IUPAC name of Acoramidis (CID 71464713) is 3-[3-(3,5-dimethyl-1H-pyrazol-4-yl)propoxy]-4-fluorobenzoic acid.
What is the SMILES notation for Acoramidis?
The canonical SMILES for Acoramidis is Cc1n[nH]c(C)c1CCCOc1cc(C(=O)O)ccc1F.
What is the InChIKey of Acoramidis?
The InChIKey is WBFUHHBPNXWNCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN2O3/c1-9-12(10(2)18-17-9)4-3-7-21-14-8-11(15(19)20)5-6-13(14)16/h5-6,8H,3-4,7H2,1-2H3,(H,17,18)(H,19,20).
What are the key properties of Acoramidis?
Acoramidis has a molecular weight of 292.31 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for Acoramidis is sourced from PubChem (CID 71464713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules: A · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.