N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide

C19H19ClN2O — CID 46463279

IUPACN-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide
SMILESCCC(NC(=O)Cc1c[nH]c2ccccc12)c1cccc(Cl)c1
InChIInChI=1S/C19H19ClN2O/c1-2-17(13-6-5-7-15(20)10-13)22-19(23)11-14-12-21-18-9-4-3-8-16(14)18/h3-10,12,17,21H,2,11H2,1H3,(H,22,23)
InChIKeyASNINDYXGFUZAX-UHFFFAOYSA-N
MW326.83 g/mol
LogP4.63
Rot. Bonds5

About N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide

N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide (PubChem CID 46463279) has the molecular formula C19H19ClN2O and a molecular weight of 326.83 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide
PubChem CID46463279
Molecular FormulaC19H19ClN2O
Molecular Weight326.83 g/mol
Exact Mass326.12
IUPAC NameN-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide
SMILESCCC(NC(=O)Cc1c[nH]c2ccccc12)c1cccc(Cl)c1
InChIInChI=1S/C19H19ClN2O/c1-2-17(13-6-5-7-15(20)10-13)22-19(23)11-14-12-21-18-9-4-3-8-16(14)18/h3-10,12,17,21H,2,11H2,1H3,(H,22,23)
InChIKeyASNINDYXGFUZAX-UHFFFAOYSA-N
XLogP4.63
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.83
LogP ≤ 54.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

ethyl 3-[[2-(1H-indol-3-yl)acetyl]amino]-3-(3-methoxyphenyl)propanoate
CID 55876805
N-[(1S)-1,2-diphenylethyl]-2-(1H-indol-3-yl)acetamide
CID 9442039
1-(3-chlorophenyl)-N-(1H-indol-3-ylmethyl)ethanamine
CID 60664434
methyl (3R)-3-(3,4-dimethoxyphenyl)-3-[[2-(1H-indol-3-yl)acetyl]amino]propanoate
CID 40855593
3-amino-N-[1-(3-chlorophenyl)propyl]-3-phenylpropanamide;hydrochloride
CID 119949676
N-(1-cyclopropylbutan-2-yl)-2-(1H-indol-3-yl)acetamide
CID 63996376
N-[(1R)-1-(4-bromophenyl)propyl]-3-(1H-indol-3-yl)propanamide
CID 41099576
N-(1-aminopentan-2-yl)-2-(1H-indol-3-yl)acetamide
CID 65190802
3-acetamido-N-[1-(3-chlorophenyl)propyl]-3-phenylpropanamide
CID 134035215
2-(1H-indol-3-yl)-N-[1-(3-sulfamoylphenyl)ethyl]acetamide
CID 78813976
2-(1H-indol-3-yl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 40810685
N-[1-(3-chlorophenyl)propyl]-3-(2-oxo-1-pyridinyl)propanamide
CID 86979645

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide (CID 46463279) is N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide is CCC(NC(=O)Cc1c[nH]c2ccccc12)c1cccc(Cl)c1.
What is the InChIKey of N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide?
The InChIKey is ASNINDYXGFUZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClN2O/c1-2-17(13-6-5-7-15(20)10-13)22-19(23)11-14-12-21-18-9-4-3-8-16(14)18/h3-10,12,17,21H,2,11H2,1H3,(H,22,23).
What are the key properties of N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide?
N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide has a molecular weight of 326.83 g/mol, XLogP of 4.63, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)propyl]-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 46463279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).