3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide

C17H18N2O2 — CID 62524941

IUPAC3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
SMILESCc1ccc(CNC(=O)CCc2c[nH]c3ccccc23)o1
InChIInChI=1S/C17H18N2O2/c1-12-6-8-14(21-12)11-19-17(20)9-7-13-10-18-16-5-3-2-4-15(13)16/h2-6,8,10,18H,7,9,11H2,1H3,(H,19,20)
InChIKeyUTIIPAGZGHLZLW-UHFFFAOYSA-N
MW282.34 g/mol
LogP3.32
Rot. Bonds5

About 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide

3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide (PubChem CID 62524941) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide.

Molecular Properties

Compound Name3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
PubChem CID62524941
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide
SMILESCc1ccc(CNC(=O)CCc2c[nH]c3ccccc23)o1
InChIInChI=1S/C17H18N2O2/c1-12-6-8-14(21-12)11-19-17(20)9-7-13-10-18-16-5-3-2-4-15(13)16/h2-6,8,10,18H,7,9,11H2,1H3,(H,19,20)
InChIKeyUTIIPAGZGHLZLW-UHFFFAOYSA-N
XLogP3.32
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 ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1H-indol-3-yl)-N-[(2-methylphenyl)methyl]propanamide
CID 17473957
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)ethyl]propanamide
CID 10664257
N-[[4-[(dimethylamino)methyl]phenyl]methyl]-3-(1H-indol-3-yl)propanamide
CID 26447481
N-[(2-bromophenyl)methyl]-3-(1H-indol-3-yl)propanamide
CID 70209057
N-hydroxy-3-(1H-indol-3-yl)propanamide
CID 23938574
N-[[4-(dimethylamino)phenyl]methyl]-3-(1H-indol-3-yl)propanamide
CID 17478687
4-(1H-indol-3-yl)-N-[2-[3-(1H-indol-3-yl)propanoylamino]ethyl]butanamide
CID 42506947
2-[3-(1H-indol-3-yl)propanoylamino]acetate
CID 7677841
N-(2-chloroprop-2-enyl)-3-(1H-indol-3-yl)propanamide
CID 115636757
N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-3-(5-methylfuran-2-yl)propanamide
CID 4893594
3-(1H-indol-3-yl)-N-[2-(1H-indol-3-yl)propyl]propanamide
CID 70207021
3-(1H-indol-3-yl)-N-(pyridin-3-ylmethyl)propanamide
CID 4806902

Frequently Asked Questions

What is the IUPAC name of 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide?
The IUPAC name of 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide (CID 62524941) is 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide.
What is the SMILES notation for 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide?
The canonical SMILES for 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide is Cc1ccc(CNC(=O)CCc2c[nH]c3ccccc23)o1.
What is the InChIKey of 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide?
The InChIKey is UTIIPAGZGHLZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-12-6-8-14(21-12)11-19-17(20)9-7-13-10-18-16-5-3-2-4-15(13)16/h2-6,8,10,18H,7,9,11H2,1H3,(H,19,20).
What are the key properties of 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide?
3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide has a molecular weight of 282.34 g/mol, XLogP of 3.32, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-indol-3-yl)-N-[(5-methylfuran-2-yl)methyl]propanamide is sourced from PubChem (CID 62524941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).