N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide

C16H16N2O3 — CID 699102

IUPACN-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
SMILESCOc1ccc2c(CCNC(=O)c3ccco3)c[nH]c2c1
InChIInChI=1S/C16H16N2O3/c1-20-12-4-5-13-11(10-18-14(13)9-12)6-7-17-16(19)15-3-2-8-21-15/h2-5,8-10,18H,6-7H2,1H3,(H,17,19)
InChIKeyMCEJKQYUNAUZDX-UHFFFAOYSA-N
MW284.31 g/mol
LogP2.74
Rot. Bonds5

About N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide

N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide (PubChem CID 699102) has the molecular formula C16H16N2O3 and a molecular weight of 284.31 g/mol. Its IUPAC name is N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
PubChem CID699102
Molecular FormulaC16H16N2O3
Molecular Weight284.31 g/mol
Exact Mass284.12
IUPAC NameN-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
SMILESCOc1ccc2c(CCNC(=O)c3ccco3)c[nH]c2c1
InChIInChI=1S/C16H16N2O3/c1-20-12-4-5-13-11(10-18-14(13)9-12)6-7-17-16(19)15-3-2-8-21-15/h2-5,8-10,18H,6-7H2,1H3,(H,17,19)
InChIKeyMCEJKQYUNAUZDX-UHFFFAOYSA-N
XLogP2.74
TPSA67.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.31
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(7-methoxynaphthalen-1-yl)ethyl]furan-2-carboxamide
CID 44581533
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3,5-dimethylbenzamide
CID 4887560
5-(benzylsulfanylmethyl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 4900829
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 110731470
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-4-[(2-methoxyphenoxy)methyl]benzamide
CID 4898664
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-2-methyl-1-oxoisoquinoline-3-carboxamide
CID 4975348
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide
CID 4893594
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-3-methyl-1,2,4-oxadiazole-5-carboxamide
CID 29147475
N-[2-(1H-indol-3-yl)ethyl]-3,5-dimethoxybenzamide
CID 9120119
N-[2-[[2-(2,4-dimethoxyphenyl)acetyl]amino]ethyl]furan-2-carboxamide
CID 24683474
N-[2-[[N-[2-(5-fluoro-1H-indol-3-yl)ethyl]-N'-methylcarbamimidoyl]amino]ethyl]furan-2-carboxamide;hydroiodide
CID 111972111
3-(5-ethylfuran-2-yl)-N-[2-(6-methoxy-1H-indol-3-yl)ethyl]but-2-enamide
CID 4972520

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide (CID 699102) is N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide is COc1ccc2c(CCNC(=O)c3ccco3)c[nH]c2c1.
What is the InChIKey of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide?
The InChIKey is MCEJKQYUNAUZDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-20-12-4-5-13-11(10-18-14(13)9-12)6-7-17-16(19)15-3-2-8-21-15/h2-5,8-10,18H,6-7H2,1H3,(H,17,19).
What are the key properties of N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide?
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide has a molecular weight of 284.31 g/mol, XLogP of 2.74, 5 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]furan-2-carboxamide is sourced from PubChem (CID 699102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).