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

C18H18N2O2 — CID 7097288

IUPACN-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NCCc1ccc(O)cc1
InChIInChI=1S/C18H18N2O2/c21-15-7-5-13(6-8-15)9-10-19-18(22)11-14-12-20-17-4-2-1-3-16(14)17/h1-8,12,20-21H,9-11H2,(H,19,22)
InChIKeyIZQAJLPHRDTNTA-UHFFFAOYSA-N
MW294.35 g/mol
LogP2.77
Rot. Bonds5

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

N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 7097288) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
PubChem CID7097288
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NCCc1ccc(O)cc1
InChIInChI=1S/C18H18N2O2/c21-15-7-5-13(6-8-15)9-10-19-18(22)11-14-12-20-17-4-2-1-3-16(14)17/h1-8,12,20-21H,9-11H2,(H,19,22)
InChIKeyIZQAJLPHRDTNTA-UHFFFAOYSA-N
XLogP2.77
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 52.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-chlorophenyl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 2114473
4-[2-[[2-(1H-indol-3-yl)acetyl]amino]ethyl]benzoic acid
CID 71900120
N-[2-(4-hydroxyphenyl)ethyl]-1H-indole-3-carboxamide
CID 61017782
N-[2-[4-(difluoromethoxy)phenyl]ethyl]-2-(1H-indol-3-yl)acetamide
CID 17412889
N-[2-(4-hydroxyphenyl)ethyl]-2-phenylacetamide
CID 11857553
N-[2-(1,3-benzodioxol-5-yl)ethyl]-2-(1H-indol-3-yl)acetamide
CID 18117801
2-[2-(1H-indol-3-yl)ethylamino]-N-(2-phenylethyl)acetamide
CID 108999978
N-[2-(4-fluorophenyl)ethyl]-2-[2-(1H-indol-3-yl)ethylamino]acetamide
CID 109000531
2-(1H-indol-3-yl)-N-methylethanamine;4-[2-(methylamino)ethyl]phenol
CID 143831830
N-[2-(1H-indol-3-yl)ethyl]-2-naphthalen-1-ylacetamide
CID 20969018
N-[2-(4-chlorophenyl)ethyl]-4-(1H-indol-3-yl)butanamide
CID 4796028
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide (CID 7097288) is N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide is O=C(Cc1c[nH]c2ccccc12)NCCc1ccc(O)cc1.
What is the InChIKey of N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is IZQAJLPHRDTNTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c21-15-7-5-13(6-8-15)9-10-19-18(22)11-14-12-20-17-4-2-1-3-16(14)17/h1-8,12,20-21H,9-11H2,(H,19,22).
What are the key properties of N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide?
N-[2-(4-hydroxyphenyl)ethyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 294.35 g/mol, XLogP of 2.77, 5 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]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 7097288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).