N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide

C19H22N2O3 — CID 4893594

IUPACN-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide
SMILESCOc1ccc2c(CCNC(=O)CCc3ccc(C)o3)c[nH]c2c1
InChIInChI=1S/C19H22N2O3/c1-13-3-4-15(24-13)6-8-19(22)20-10-9-14-12-21-18-11-16(23-2)5-7-17(14)18/h3-5,7,11-12,21H,6,8-10H2,1-2H3,(H,20,22)
InChIKeyPSKXGFCGGBUMEL-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.37
Rot. Bonds7

About N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide

N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide (PubChem CID 4893594) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide
PubChem CID4893594
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide
SMILESCOc1ccc2c(CCNC(=O)CCc3ccc(C)o3)c[nH]c2c1
InChIInChI=1S/C19H22N2O3/c1-13-3-4-15(24-13)6-8-19(22)20-10-9-14-12-21-18-11-16(23-2)5-7-17(14)18/h3-5,7,11-12,21H,6,8-10H2,1-2H3,(H,20,22)
InChIKeyPSKXGFCGGBUMEL-UHFFFAOYSA-N
XLogP3.37
TPSA67.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-3-[5-(4-methoxyphenyl)furan-2-yl]propanamide
CID 4972255
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,5-dimethylbenzamide
CID 4887560
3-(5-ethylfuran-2-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]but-2-enamide
CID 4972520
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 699102
3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
CID 62524941
4-amino-N-[2-(5-methoxy-1H-indol-3-yl)ethyl]butanamide
CID 26652
5-(benzylsulfanylmethyl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 4900829
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-methylsulfonylpropanamide
CID 131951038
ethyl 3-[2-(5-methoxy-1H-indol-3-yl)ethylamino]-3-oxopropanoate
CID 18794243
N-[2-(6-hydroxy-1H-indol-3-yl)ethyl]-3-methoxypropanamide
CID 84581868
3-(5-methylfuran-2-yl)-N-[3-[3-(5-methylfuran-2-yl)propanoylamino]propyl]propanamide
CID 4780000
[3-(2-acetamidoethyl)-1H-indol-6-yl] acetate
CID 169222411

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide?
The IUPAC name of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide (CID 4893594) is N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide.
What is the SMILES notation for N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide?
The canonical SMILES for N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide is COc1ccc2c(CCNC(=O)CCc3ccc(C)o3)c[nH]c2c1.
What is the InChIKey of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide?
The InChIKey is PSKXGFCGGBUMEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13-3-4-15(24-13)6-8-19(22)20-10-9-14-12-21-18-11-16(23-2)5-7-17(14)18/h3-5,7,11-12,21H,6,8-10H2,1-2H3,(H,20,22).
What are the key properties of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide?
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide has a molecular weight of 326.40 g/mol, XLogP of 3.37, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide is sourced from PubChem (CID 4893594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).