N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide

C19H20N2O2 — CID 7097194

IUPACN-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)NCCc1ccc(O)cc1
InChIInChI=1S/C19H20N2O2/c22-16-8-5-14(6-9-16)11-12-20-19(23)10-7-15-13-21-18-4-2-1-3-17(15)18/h1-6,8-9,13,21-22H,7,10-12H2,(H,20,23)
InChIKeyOGBOHXYUBHDVMN-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.16
Rot. Bonds6

About N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide

N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide (PubChem CID 7097194) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide
PubChem CID7097194
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide
SMILESO=C(CCc1c[nH]c2ccccc12)NCCc1ccc(O)cc1
InChIInChI=1S/C19H20N2O2/c22-16-8-5-14(6-9-16)11-12-20-19(23)10-7-15-13-21-18-4-2-1-3-17(15)18/h1-6,8-9,13,21-22H,7,10-12H2,(H,20,23)
InChIKeyOGBOHXYUBHDVMN-UHFFFAOYSA-N
XLogP3.16
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide (CID 7097194) is N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide is O=C(CCc1c[nH]c2ccccc12)NCCc1ccc(O)cc1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide?
The InChIKey is OGBOHXYUBHDVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c22-16-8-5-14(6-9-16)11-12-20-19(23)10-7-15-13-21-18-4-2-1-3-17(15)18/h1-6,8-9,13,21-22H,7,10-12H2,(H,20,23).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide?
N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide has a molecular weight of 308.38 g/mol, XLogP of 3.16, 6 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-hydroxyphenyl)ethyl]-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 7097194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).