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

C15H14N2O2 — CID 24531997

IUPACN-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1ccoc1
InChIInChI=1S/C15H14N2O2/c18-15(12-6-8-19-10-12)16-7-5-11-9-17-14-4-2-1-3-13(11)14/h1-4,6,8-10,17H,5,7H2,(H,16,18)
InChIKeyCYRJPQBVNYYLKP-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.73
Rot. Bonds4

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

N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide (PubChem CID 24531997) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide
PubChem CID24531997
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC NameN-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide
SMILESO=C(NCCc1c[nH]c2ccccc12)c1ccoc1
InChIInChI=1S/C15H14N2O2/c18-15(12-6-8-19-10-12)16-7-5-11-9-17-14-4-2-1-3-13(11)14/h1-4,6,8-10,17H,5,7H2,(H,16,18)
InChIKeyCYRJPQBVNYYLKP-UHFFFAOYSA-N
XLogP2.73
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide?
The IUPAC name of N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide (CID 24531997) is N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide is O=C(NCCc1c[nH]c2ccccc12)c1ccoc1.
What is the InChIKey of N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide?
The InChIKey is CYRJPQBVNYYLKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c18-15(12-6-8-19-10-12)16-7-5-11-9-17-14-4-2-1-3-13(11)14/h1-4,6,8-10,17H,5,7H2,(H,16,18).
What are the key properties of N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide?
N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide has a molecular weight of 254.29 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)ethyl]furan-3-carboxamide is sourced from PubChem (CID 24531997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).