N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide

C20H18N2O2S — CID 72717875

IUPACN-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide
SMILESO=C(c1cc2ccccc2[nH]1)N(CCc1cccs1)Cc1ccco1
InChIInChI=1S/C20H18N2O2S/c23-20(19-13-15-5-1-2-8-18(15)21-19)22(14-16-6-3-11-24-16)10-9-17-7-4-12-25-17/h1-8,11-13,21H,9-10,14H2
InChIKeyACUKYRLCBMUVDC-UHFFFAOYSA-N
MW350.44 g/mol
LogP4.71
Rot. Bonds6

About N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide

N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide (PubChem CID 72717875) has the molecular formula C20H18N2O2S and a molecular weight of 350.44 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide
PubChem CID72717875
Molecular FormulaC20H18N2O2S
Molecular Weight350.44 g/mol
Exact Mass350.11
IUPAC NameN-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide
SMILESO=C(c1cc2ccccc2[nH]1)N(CCc1cccs1)Cc1ccco1
InChIInChI=1S/C20H18N2O2S/c23-20(19-13-15-5-1-2-8-18(15)21-19)22(14-16-6-3-11-24-16)10-9-17-7-4-12-25-17/h1-8,11-13,21H,9-10,14H2
InChIKeyACUKYRLCBMUVDC-UHFFFAOYSA-N
XLogP4.71
TPSA49.24 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.44
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide (CID 72717875) is N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide is O=C(c1cc2ccccc2[nH]1)N(CCc1cccs1)Cc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide?
The InChIKey is ACUKYRLCBMUVDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O2S/c23-20(19-13-15-5-1-2-8-18(15)21-19)22(14-16-6-3-11-24-16)10-9-17-7-4-12-25-17/h1-8,11-13,21H,9-10,14H2.
What are the key properties of N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide?
N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide has a molecular weight of 350.44 g/mol, XLogP of 4.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-(2-thiophen-2-ylethyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 72717875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).