N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide

C20H17N3O3S — CID 31302572

IUPACN-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)NCCc2c[nH]c3ccccc23)s1)c1ccco1
InChIInChI=1S/C20H17N3O3S/c24-19(16-6-3-11-26-16)23-18-8-7-17(27-18)20(25)21-10-9-13-12-22-15-5-2-1-4-14(13)15/h1-8,11-12,22H,9-10H2,(H,21,25)(H,23,24)
InChIKeyVYWFGLGIIHCMDU-UHFFFAOYSA-N
MW379.44 g/mol
LogP4.05
Rot. Bonds6

About N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide

N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide (PubChem CID 31302572) has the molecular formula C20H17N3O3S and a molecular weight of 379.44 g/mol. Its IUPAC name is N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
PubChem CID31302572
Molecular FormulaC20H17N3O3S
Molecular Weight379.44 g/mol
Exact Mass379.10
IUPAC NameN-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)NCCc2c[nH]c3ccccc23)s1)c1ccco1
InChIInChI=1S/C20H17N3O3S/c24-19(16-6-3-11-26-16)23-18-8-7-17(27-18)20(25)21-10-9-13-12-22-15-5-2-1-4-14(13)15/h1-8,11-12,22H,9-10H2,(H,21,25)(H,23,24)
InChIKeyVYWFGLGIIHCMDU-UHFFFAOYSA-N
XLogP4.05
TPSA87.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.44
LogP ≤ 54.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide with MolForge

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Related Compounds

N-[5-(3-methoxypropylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
CID 51330650
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 110731470
N-[2-(1H-indol-3-yl)ethyl]thiophene-2-carboxamide;oxalic acid
CID 17365887
1-N,4-N-bis[2-(1H-indol-3-yl)ethyl]benzene-1,4-dicarboxamide
CID 42988811
N-[2-(furan-2-carbonylamino)ethyl]-1H-indole-3-carboxamide
CID 42581260
N-[2-(1H-indol-3-yl)ethyl]-2-methyl-1,3-thiazole-5-carboxamide
CID 110853376
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]furan-2-carboxamide
CID 699102
N-[5-[(2-methoxyphenyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31302984
4-amino-N-[2-(1H-indol-3-yl)ethyl]-5-methylthiophene-2-carboxamide
CID 61117378
N-[5-[2-(4-bromophenyl)sulfanylethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 38613730
N-[5-[(3,4,5-trimethoxyphenyl)methylcarbamoyl]thiophen-2-yl]furan-2-carboxamide
CID 31309961
N-[2-(1H-indol-3-yl)ethyl]-3-methyl-1-benzothiophene-2-carboxamide
CID 27645794

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide?
The IUPAC name of N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide (CID 31302572) is N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide is O=C(Nc1ccc(C(=O)NCCc2c[nH]c3ccccc23)s1)c1ccco1.
What is the InChIKey of N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide?
The InChIKey is VYWFGLGIIHCMDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3S/c24-19(16-6-3-11-26-16)23-18-8-7-17(27-18)20(25)21-10-9-13-12-22-15-5-2-1-4-14(13)15/h1-8,11-12,22H,9-10H2,(H,21,25)(H,23,24).
What are the key properties of N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide?
N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide has a molecular weight of 379.44 g/mol, XLogP of 4.05, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(1H-indol-3-yl)ethylcarbamoyl]thiophen-2-yl]furan-2-carboxamide is sourced from PubChem (CID 31302572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).