N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide

C20H23N3O — CID 74236302

IUPACN-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide
SMILESCc1cc2ccccc2n1CCN(C)C(=O)CCc1ccncc1
InChIInChI=1S/C20H23N3O/c1-16-15-18-5-3-4-6-19(18)23(16)14-13-22(2)20(24)8-7-17-9-11-21-12-10-17/h3-6,9-12,15H,7-8,13-14H2,1-2H3
InChIKeyBKUMEAGLODZEQE-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.44
Rot. Bonds6

About N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide

N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide (PubChem CID 74236302) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide
PubChem CID74236302
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC NameN-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide
SMILESCc1cc2ccccc2n1CCN(C)C(=O)CCc1ccncc1
InChIInChI=1S/C20H23N3O/c1-16-15-18-5-3-4-6-19(18)23(16)14-13-22(2)20(24)8-7-17-9-11-21-12-10-17/h3-6,9-12,15H,7-8,13-14H2,1-2H3
InChIKeyBKUMEAGLODZEQE-UHFFFAOYSA-N
XLogP3.44
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(3-methylbutyl)-3-pyridin-4-ylpropanamide
CID 78897799
methyl 3-[methyl-[2-(2-methylindol-1-yl)acetyl]amino]propanoate
CID 61030565
3-[1-(dimethylamino)propan-2-yl]-1-methyl-1-[2-(2-methylindol-1-yl)ethyl]urea
CID 121494289
N-methyl-N-(3-phenoxypropyl)-3-pyridin-4-ylpropanamide
CID 60508904
N-methyl-3-[methyl(2-pyridin-4-ylethyl)amino]-N-(2-pyridin-4-ylethyl)propanamide
CID 109025999
2-(2-methylindol-1-yl)-N-pyridin-4-ylacetamide
CID 27700402
3-(2-chlorophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)propanamide
CID 77080685
3-(2-aminophenyl)-N-methyl-N-(2-pyridin-4-ylethyl)propanamide
CID 28713762
methyl 2-[methyl(3-pyridin-4-ylpropanoyl)amino]acetate
CID 112729455
3-[3-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]-1-methyl-1-[2-(2-methylindol-1-yl)ethyl]urea
CID 122561620
4-[2-(2-methylindol-1-yl)ethyl]aniline
CID 43519624
2-tert-butyl-N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 70727206

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide?
The IUPAC name of N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide (CID 74236302) is N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide is Cc1cc2ccccc2n1CCN(C)C(=O)CCc1ccncc1.
What is the InChIKey of N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide?
The InChIKey is BKUMEAGLODZEQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c1-16-15-18-5-3-4-6-19(18)23(16)14-13-22(2)20(24)8-7-17-9-11-21-12-10-17/h3-6,9-12,15H,7-8,13-14H2,1-2H3.
What are the key properties of N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide?
N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide has a molecular weight of 321.42 g/mol, XLogP of 3.44, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(2-methylindol-1-yl)ethyl]-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 74236302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).