N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide

C16H16N2O2 — CID 45069388

IUPACN-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide
SMILESCn1cc(CCNC(=O)c2ccco2)c2ccccc21
InChIInChI=1S/C16H16N2O2/c1-18-11-12(13-5-2-3-6-14(13)18)8-9-17-16(19)15-7-4-10-20-15/h2-7,10-11H,8-9H2,1H3,(H,17,19)
InChIKeyGHCSHSOEPUSFAK-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.74
Rot. Bonds4

About N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide

N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide (PubChem CID 45069388) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide
PubChem CID45069388
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC NameN-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide
SMILESCn1cc(CCNC(=O)c2ccco2)c2ccccc21
InChIInChI=1S/C16H16N2O2/c1-18-11-12(13-5-2-3-6-14(13)18)8-9-17-16(19)15-7-4-10-20-15/h2-7,10-11H,8-9H2,1H3,(H,17,19)
InChIKeyGHCSHSOEPUSFAK-UHFFFAOYSA-N
XLogP2.74
TPSA47.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
methyl N-[2-(1-methylindol-3-yl)ethyl]carbamate
CID 14613226
2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 82495529
N-[2-(1-methylindol-3-yl)ethyl]-2-thiophen-2-ylacetamide
CID 110731525
N-[2-(1-methylindol-3-yl)ethyl]pyrazine-2-carboxamide
CID 110745123
2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 11196581
N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide
CID 40718604
N-[(Z)-1-(1-methylindol-3-yl)-3-oxo-3-(propylamino)prop-1-en-2-yl]furan-2-carboxamide
CID 46262201
1-cyclopentyl-3-[2-(1-methylindol-3-yl)ethyl]urea
CID 110748890
N-[2-(furan-2-yl)-2-hydroxypropyl]-2-(1-methylindol-3-yl)acetamide
CID 111482750
N-ethyl-3-(1-methylindol-3-yl)propanamide
CID 167074114
N-(2-aminoethyl)-2-(1-methylindol-3-yl)acetamide
CID 82289252

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide (CID 45069388) is N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide is Cn1cc(CCNC(=O)c2ccco2)c2ccccc21.
What is the InChIKey of N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide?
The InChIKey is GHCSHSOEPUSFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-18-11-12(13-5-2-3-6-14(13)18)8-9-17-16(19)15-7-4-10-20-15/h2-7,10-11H,8-9H2,1H3,(H,17,19).
What are the key properties of N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide?
N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide has a molecular weight of 268.32 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-methylindol-3-yl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 45069388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).