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

C17H18N2O2 — CID 41273168

IUPACN-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide
SMILESC[C@@H](NC(=O)CCc1c[nH]c2ccccc12)c1ccco1
InChIInChI=1S/C17H18N2O2/c1-12(16-7-4-10-21-16)19-17(20)9-8-13-11-18-15-6-3-2-5-14(13)15/h2-7,10-12,18H,8-9H2,1H3,(H,19,20)/t12-/m1/s1
InChIKeyJWCZDFXGSRNPQG-GFCCVEGCSA-N
MW282.34 g/mol
LogP3.57
Rot. Bonds5

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

N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide (PubChem CID 41273168) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide.

Molecular Properties

Compound NameN-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide
PubChem CID41273168
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide
SMILESC[C@@H](NC(=O)CCc1c[nH]c2ccccc12)c1ccco1
InChIInChI=1S/C17H18N2O2/c1-12(16-7-4-10-21-16)19-17(20)9-8-13-11-18-15-6-3-2-5-14(13)15/h2-7,10-12,18H,8-9H2,1H3,(H,19,20)/t12-/m1/s1
InChIKeyJWCZDFXGSRNPQG-GFCCVEGCSA-N
XLogP3.57
TPSA58.03 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1H-indol-3-yl)-N-(1-phenylethyl)propanamide
CID 582677
N-[2-(furan-2-yl)-2-hydroxyethyl]-3-(1H-indol-3-yl)propanamide
CID 110889323
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide
CID 25470256
3-(1H-indol-3-yl)-N-[(1R)-1-thiophen-2-ylethyl]propanamide
CID 41291005
N-[1-[4-(dimethylamino)phenyl]ethyl]-3-(1H-indol-3-yl)propanamide
CID 70160592
2-[3-(1H-indol-3-yl)propanoylamino]-N-methylpropanamide
CID 47315730
3-(1H-indol-3-yl)-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 4794791
3-(1H-indol-3-yl)-N-(1-methoxypropan-2-yl)propanamide
CID 18074487
4-(1H-indol-3-yl)-N-(1-phenylethyl)butanamide
CID 4806761
3-(1H-indol-3-yl)-N-[(2S)-pent-4-en-2-yl]propanamide
CID 97086843
N-(3-hydroxy-2-methylbutan-2-yl)-3-(1H-indol-3-yl)propanamide
CID 115884530
N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-(1H-indol-3-yl)propanamide
CID 4807743

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide?
The IUPAC name of N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide (CID 41273168) is N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide.
What is the SMILES notation for N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide?
The canonical SMILES for N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide is C[C@@H](NC(=O)CCc1c[nH]c2ccccc12)c1ccco1.
What is the InChIKey of N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide?
The InChIKey is JWCZDFXGSRNPQG-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12(16-7-4-10-21-16)19-17(20)9-8-13-11-18-15-6-3-2-5-14(13)15/h2-7,10-12,18H,8-9H2,1H3,(H,19,20)/t12-/m1/s1.
What are the key properties of N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide?
N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide has a molecular weight of 282.34 g/mol, XLogP of 3.57, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(furan-2-yl)ethyl]-3-(1H-indol-3-yl)propanamide is sourced from PubChem (CID 41273168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).