N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide

C16H17N3O — CID 138964414

IUPACN-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide
SMILESCn1cccc1CC(=O)Nc1ccc2c(ccn2C)c1
InChIInChI=1S/C16H17N3O/c1-18-8-3-4-14(18)11-16(20)17-13-5-6-15-12(10-13)7-9-19(15)2/h3-10H,11H2,1-2H3,(H,17,20)
InChIKeyKVUACBFXBRDKNF-UHFFFAOYSA-N
MW267.33 g/mol
LogP2.70
Rot. Bonds3

About N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide

N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide (PubChem CID 138964414) has the molecular formula C16H17N3O and a molecular weight of 267.33 g/mol. Its IUPAC name is N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide.

Molecular Properties

Compound NameN-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide
PubChem CID138964414
Molecular FormulaC16H17N3O
Molecular Weight267.33 g/mol
Exact Mass267.14
IUPAC NameN-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide
SMILESCn1cccc1CC(=O)Nc1ccc2c(ccn2C)c1
InChIInChI=1S/C16H17N3O/c1-18-8-3-4-14(18)11-16(20)17-13-5-6-15-12(10-13)7-9-19(15)2/h3-10H,11H2,1-2H3,(H,17,20)
InChIKeyKVUACBFXBRDKNF-UHFFFAOYSA-N
XLogP2.70
TPSA38.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-methyl-N-(1-methylindol-5-yl)butanamide
CID 110838357
1-(1-methylindol-5-yl)-3-phenylurea;hydrochloride
CID 45259292
(2S)-2-amino-3-methyl-N-(1-methylindol-5-yl)butanamide
CID 110837856
3-amino-2-methyl-N-(1-methylindol-5-yl)propanamide
CID 110838398
N-(1-methylindol-5-yl)-2-(3-oxo-1,2-dihydroisoindol-1-yl)acetamide
CID 71701889
4-tert-butyl-N-(1-methylindol-5-yl)benzamide
CID 70990201
N-(1-methylindol-5-yl)-3-pyrrol-1-yl-3-thiophen-3-ylpropanamide
CID 121240660
methyl 2-[(1-methylindol-5-yl)amino]acetate
CID 82539684
1-[[2-(1-methylpyrrol-2-yl)acetyl]amino]-3-phenylurea
CID 1225228
3-methoxy-N-(1-methylindol-5-yl)benzamide
CID 110867789
2-[(4R)-2,5-dioxo-1-(2-phenylethyl)imidazolidin-4-yl]-N-(1-methylindol-5-yl)acetamide
CID 99871302
N-(3-acetamidophenyl)-3-(1-methylpyrrol-2-yl)propanamide
CID 110700760

Frequently Asked Questions

What is the IUPAC name of N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide?
The IUPAC name of N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide (CID 138964414) is N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide.
What is the SMILES notation for N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide?
The canonical SMILES for N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide is Cn1cccc1CC(=O)Nc1ccc2c(ccn2C)c1.
What is the InChIKey of N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide?
The InChIKey is KVUACBFXBRDKNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O/c1-18-8-3-4-14(18)11-16(20)17-13-5-6-15-12(10-13)7-9-19(15)2/h3-10H,11H2,1-2H3,(H,17,20).
What are the key properties of N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide?
N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide has a molecular weight of 267.33 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylindol-5-yl)-2-(1-methylpyrrol-2-yl)acetamide is sourced from PubChem (CID 138964414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).