N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide

C15H18N2O2 — CID 60654256

IUPACN-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide
SMILESC=COCCCNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C15H18N2O2/c1-2-19-9-5-8-16-15(18)10-12-11-17-14-7-4-3-6-13(12)14/h2-4,6-7,11,17H,1,5,8-10H2,(H,16,18)
InChIKeyQWQTWJHYILGJHJ-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.38
Rot. Bonds7

About N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide

N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide (PubChem CID 60654256) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide
PubChem CID60654256
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide
SMILESC=COCCCNC(=O)Cc1c[nH]c2ccccc12
InChIInChI=1S/C15H18N2O2/c1-2-19-9-5-8-16-15(18)10-12-11-17-14-7-4-3-6-13(12)14/h2-4,6-7,11,17H,1,5,8-10H2,(H,16,18)
InChIKeyQWQTWJHYILGJHJ-UHFFFAOYSA-N
XLogP2.38
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[4-(4-fluorophenoxy)butyl]-2-(1H-indol-3-yl)acetamide
CID 17405014
hydroxylamine;6-[[2-(1H-indol-3-yl)acetyl]amino]hexanoic acid
CID 70007907
N-hex-5-ynyl-2-(1H-indol-3-yl)acetamide
CID 113256112
N-(4,4-diphenylbutyl)-2-(1H-indol-3-yl)acetamide
CID 178070448
N-[2-(2-chlorophenoxy)ethyl]-2-(1H-indol-3-yl)acetamide
CID 86069599
N-(4-amino-5-hydroxyhex-5-enyl)-2-(1H-indol-3-yl)acetamide
CID 144920872
methyl 3-[[2-(1H-indol-3-yl)acetyl]amino]propanoate
CID 2539049
N-(4,4-diethoxybutyl)-2-(1H-indol-3-yl)acetamide
CID 23660155
N-[2-(4-ethylphenoxy)ethyl]-2-(1H-indol-3-yl)acetamide
CID 113100092
N-[2-(1H-indol-3-yl)ethyl]-2-(2-methoxyethylamino)acetamide
CID 78912609
[2-(2-methoxyethylamino)-2-oxoethyl] 2-(1H-indol-3-yl)acetate
CID 7960167
N-cyclopropyl-3-[[2-(1H-indol-3-yl)acetyl]amino]propanamide
CID 79382425

Frequently Asked Questions

What is the IUPAC name of N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide (CID 60654256) is N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide is C=COCCCNC(=O)Cc1c[nH]c2ccccc12.
What is the InChIKey of N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide?
The InChIKey is QWQTWJHYILGJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-2-19-9-5-8-16-15(18)10-12-11-17-14-7-4-3-6-13(12)14/h2-4,6-7,11,17H,1,5,8-10H2,(H,16,18).
What are the key properties of N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide?
N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide has a molecular weight of 258.32 g/mol, XLogP of 2.38, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethenoxypropyl)-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 60654256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).