2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide

C14H19N3O — CID 131907510

IUPAC2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide
SMILESCCn1c(C)cc2cc(NC(=O)C(C)N)ccc21
InChIInChI=1S/C14H19N3O/c1-4-17-9(2)7-11-8-12(5-6-13(11)17)16-14(18)10(3)15/h5-8,10H,4,15H2,1-3H3,(H,16,18)
InChIKeyPGJYFLUAVLYLIB-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.26
Rot. Bonds3

About 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide

2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide (PubChem CID 131907510) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide.

Molecular Properties

Compound Name2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide
PubChem CID131907510
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide
SMILESCCn1c(C)cc2cc(NC(=O)C(C)N)ccc21
InChIInChI=1S/C14H19N3O/c1-4-17-9(2)7-11-8-12(5-6-13(11)17)16-14(18)10(3)15/h5-8,10H,4,15H2,1-3H3,(H,16,18)
InChIKeyPGJYFLUAVLYLIB-UHFFFAOYSA-N
XLogP2.26
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethyl-2-methylindol-5-yl)-2-propan-2-yl-1,3-thiazole-4-carboxamide
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N-(1-ethyl-2-methylindol-5-yl)-2,4-dimethyl-1,3-oxazole-5-carboxamide
CID 131932657
4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide
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1-(1-ethyl-2-methylindol-5-yl)-3-[(2R)-1-(1,2,4-triazol-1-yl)propan-2-yl]urea
CID 125174038
N-(1-ethyl-2-methylindol-5-yl)-1-methylazepane-2-carboxamide
CID 131946732
1-ethyl-2-methyl-5-propan-2-ylindole
CID 155701279
(2R)-2-amino-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)propanamide;hydrochloride
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1-ethyl-5-(propanoylamino)indole-2-carboxamide
CID 90488702
N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide
CID 131946875
(2S)-2-amino-N-(4-fluoro-3-methylphenyl)propanamide
CID 62813030
2-amino-N-(3-bromo-4-methylphenyl)propanamide
CID 63334898

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide?
The IUPAC name of 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide (CID 131907510) is 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide.
What is the SMILES notation for 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide?
The canonical SMILES for 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide is CCn1c(C)cc2cc(NC(=O)C(C)N)ccc21.
What is the InChIKey of 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide?
The InChIKey is PGJYFLUAVLYLIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-4-17-9(2)7-11-8-12(5-6-13(11)17)16-14(18)10(3)15/h5-8,10H,4,15H2,1-3H3,(H,16,18).
What are the key properties of 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide?
2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide has a molecular weight of 245.33 g/mol, XLogP of 2.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide is sourced from PubChem (CID 131907510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).