N-ethyl-3-(1-methylindol-3-yl)propanamide

C14H18N2O — CID 167074114

IUPACN-ethyl-3-(1-methylindol-3-yl)propanamide
SMILESCCNC(=O)CCc1cn(C)c2ccccc12
InChIInChI=1S/C14H18N2O/c1-3-15-14(17)9-8-11-10-16(2)13-7-5-4-6-12(11)13/h4-7,10H,3,8-9H2,1-2H3,(H,15,17)
InChIKeyKWNZBPHKGXYNLP-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.25
Rot. Bonds4

About N-ethyl-3-(1-methylindol-3-yl)propanamide

N-ethyl-3-(1-methylindol-3-yl)propanamide (PubChem CID 167074114) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is N-ethyl-3-(1-methylindol-3-yl)propanamide.

Molecular Properties

Compound NameN-ethyl-3-(1-methylindol-3-yl)propanamide
PubChem CID167074114
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC NameN-ethyl-3-(1-methylindol-3-yl)propanamide
SMILESCCNC(=O)CCc1cn(C)c2ccccc12
InChIInChI=1S/C14H18N2O/c1-3-15-14(17)9-8-11-10-16(2)13-7-5-4-6-12(11)13/h4-7,10H,3,8-9H2,1-2H3,(H,15,17)
InChIKeyKWNZBPHKGXYNLP-UHFFFAOYSA-N
XLogP2.25
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-methylindol-3-yl)-N-propan-2-ylpropanamide
CID 110847846
3-(1-methylindol-3-yl)-N-(2-pyridin-2-ylethyl)propanamide
CID 71702593
2-amino-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 82495529
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
3-[(1-methylindol-3-yl)methylamino]-N-propylpropanamide
CID 107235569
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
4-methoxy-2-[3-(1-methylindol-3-yl)propanoylamino]butanoic acid
CID 120702815
methyl N-[2-(1-methylindol-3-yl)ethyl]carbamate
CID 14613226
2-acetamido-N-[2-(1-methylindol-3-yl)ethyl]acetamide
CID 11196581
N-(5-methyl-1H-imidazol-2-yl)-3-(1-methylindol-3-yl)propanamide
CID 71913209
cis-(1R,3S)-3-[3-(1-methylindol-3-yl)propanoylamino]cyclopentane-1-carboxylic acid
CID 120678962

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(1-methylindol-3-yl)propanamide?
The IUPAC name of N-ethyl-3-(1-methylindol-3-yl)propanamide (CID 167074114) is N-ethyl-3-(1-methylindol-3-yl)propanamide.
What is the SMILES notation for N-ethyl-3-(1-methylindol-3-yl)propanamide?
The canonical SMILES for N-ethyl-3-(1-methylindol-3-yl)propanamide is CCNC(=O)CCc1cn(C)c2ccccc12.
What is the InChIKey of N-ethyl-3-(1-methylindol-3-yl)propanamide?
The InChIKey is KWNZBPHKGXYNLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-3-15-14(17)9-8-11-10-16(2)13-7-5-4-6-12(11)13/h4-7,10H,3,8-9H2,1-2H3,(H,15,17).
What are the key properties of N-ethyl-3-(1-methylindol-3-yl)propanamide?
N-ethyl-3-(1-methylindol-3-yl)propanamide has a molecular weight of 230.31 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(1-methylindol-3-yl)propanamide is sourced from PubChem (CID 167074114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).