3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide

C15H20N2O — CID 110847846

IUPAC3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCc1cn(C)c2ccccc12
InChIInChI=1S/C15H20N2O/c1-11(2)16-15(18)9-8-12-10-17(3)14-7-5-4-6-13(12)14/h4-7,10-11H,8-9H2,1-3H3,(H,16,18)
InChIKeyBNGDKJIJFUGSGH-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.64
Rot. Bonds4

About 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide

3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide (PubChem CID 110847846) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
PubChem CID110847846
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
SMILESCC(C)NC(=O)CCc1cn(C)c2ccccc12
InChIInChI=1S/C15H20N2O/c1-11(2)16-15(18)9-8-12-10-17(3)14-7-5-4-6-13(12)14/h4-7,10-11H,8-9H2,1-3H3,(H,16,18)
InChIKeyBNGDKJIJFUGSGH-UHFFFAOYSA-N
XLogP2.64
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-methylindol-3-yl)-N-propan-2-ylacetamide
CID 13010552
N-ethyl-3-(1-methylindol-3-yl)propanamide
CID 167074114
4-methoxy-2-[3-(1-methylindol-3-yl)propanoylamino]butanoic acid
CID 120702815
N-[(1S)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-3-(1-methylindol-3-yl)propanamide
CID 124828756
3-methyl-5-(1-methylindol-3-yl)pentan-2-one
CID 58492260
N-[(1-methylindol-3-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 115158236
4-(1-methylindol-3-yl)butanamide
CID 175206986
3-(1-methylindol-3-yl)-N-(2-methyl-1,2,4-triazol-3-yl)propanamide
CID 71917336
N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide
CID 71913209
3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 71702593
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 82495529

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide?
The IUPAC name of 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide (CID 110847846) is 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide.
What is the SMILES notation for 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide?
The canonical SMILES for 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide is CC(C)NC(=O)CCc1cn(C)c2ccccc12.
What is the InChIKey of 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide?
The InChIKey is BNGDKJIJFUGSGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-11(2)16-15(18)9-8-12-10-17(3)14-7-5-4-6-13(12)14/h4-7,10-11H,8-9H2,1-3H3,(H,16,18).
What are the key properties of 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide?
3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide has a molecular weight of 244.34 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide is sourced from PubChem (CID 110847846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).