N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide

C19H19FN2O — CID 49409514

IUPACN-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCCc1c[nH]c2cc(F)ccc12
InChIInChI=1S/C19H19FN2O/c20-16-7-8-17-15(13-22-18(17)12-16)10-11-21-19(23)9-6-14-4-2-1-3-5-14/h1-5,7-8,12-13,22H,6,9-11H2,(H,21,23)
InChIKeyHWQTVDZQMQEWNB-UHFFFAOYSA-N
MW310.37 g/mol
LogP3.60
Rot. Bonds6

About N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide

N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide (PubChem CID 49409514) has the molecular formula C19H19FN2O and a molecular weight of 310.37 g/mol. Its IUPAC name is N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide
PubChem CID49409514
Molecular FormulaC19H19FN2O
Molecular Weight310.37 g/mol
Exact Mass310.15
IUPAC NameN-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)NCCc1c[nH]c2cc(F)ccc12
InChIInChI=1S/C19H19FN2O/c20-16-7-8-17-15(13-22-18(17)12-16)10-11-21-19(23)9-6-14-4-2-1-3-5-14/h1-5,7-8,12-13,22H,6,9-11H2,(H,21,23)
InChIKeyHWQTVDZQMQEWNB-UHFFFAOYSA-N
XLogP3.60
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.37
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-bromophenyl)-N-[2-(6-fluoro-1H-indol-3-yl)ethyl]acetamide
CID 113083740
2-[[ethylamino-[2-(6-fluoro-1H-indol-3-yl)ethylamino]methylidene]amino]-N-(2-phenylethyl)acetamide;hydroiodide
CID 111888256
N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-2-methylpropanamide
CID 49408649
2,6-difluoro-N-[2-(6-fluoro-1H-indol-3-yl)ethyl]benzamide
CID 49408660
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-(4-propan-2-ylphenyl)propanamide
CID 4973985
3-(4-aminophenyl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 28712929
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-2-(3-fluorophenyl)acetamide
CID 110731491
N-[2-(1H-indol-3-yl)ethyl]-3-(4-methylphenyl)propanamide
CID 16574540
3-[(4-fluorophenyl)methylamino]-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 109021183
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-phenoxypropanamide
CID 110731483
(2R)-2-amino-N-[2-(6-fluoro-1H-indol-3-yl)ethyl]propanamide
CID 119280010

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide?
The IUPAC name of N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide (CID 49409514) is N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide?
The canonical SMILES for N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide is O=C(CCc1ccccc1)NCCc1c[nH]c2cc(F)ccc12.
What is the InChIKey of N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide?
The InChIKey is HWQTVDZQMQEWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O/c20-16-7-8-17-15(13-22-18(17)12-16)10-11-21-19(23)9-6-14-4-2-1-3-5-14/h1-5,7-8,12-13,22H,6,9-11H2,(H,21,23).
What are the key properties of N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide?
N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide has a molecular weight of 310.37 g/mol, XLogP of 3.60, 6 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-3-phenylpropanamide is sourced from PubChem (CID 49409514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).