N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide

C24H25N3O — CID 110620139

IUPACN-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide
SMILESO=C(NCCN1CCc2ccccc21)C(Cc1ccncc1)c1ccccc1
InChIInChI=1S/C24H25N3O/c28-24(26-15-17-27-16-12-21-8-4-5-9-23(21)27)22(20-6-2-1-3-7-20)18-19-10-13-25-14-11-19/h1-11,13-14,22H,12,15-18H2,(H,26,28)
InChIKeyJIADAIVMMOCUQQ-UHFFFAOYSA-N
MW371.48 g/mol
LogP3.59
Rot. Bonds7

About N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide

N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide (PubChem CID 110620139) has the molecular formula C24H25N3O and a molecular weight of 371.48 g/mol. Its IUPAC name is N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide.

Molecular Properties

Compound NameN-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide
PubChem CID110620139
Molecular FormulaC24H25N3O
Molecular Weight371.48 g/mol
Exact Mass371.20
IUPAC NameN-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide
SMILESO=C(NCCN1CCc2ccccc21)C(Cc1ccncc1)c1ccccc1
InChIInChI=1S/C24H25N3O/c28-24(26-15-17-27-16-12-21-8-4-5-9-23(21)27)22(20-6-2-1-3-7-20)18-19-10-13-25-14-11-19/h1-11,13-14,22H,12,15-18H2,(H,26,28)
InChIKeyJIADAIVMMOCUQQ-UHFFFAOYSA-N
XLogP3.59
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-methyl-3-phenylpropanamide
CID 110353132
1-(2,3-dihydroindol-1-yl)-2-phenyl-3-pyridin-4-ylpropan-1-one
CID 110417579
N-[2-(2-morpholin-4-ylethylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110625276
1-(2-pyridin-4-ylethyl)-2,3-dihydroindole
CID 25056
2-(2,3-dihydroindol-1-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 47389879
(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
CID 97194945
(2S)-3-(4-hydroxyphenyl)-2-phenyl-N-(2-piperidin-1-ylethyl)propanamide
CID 97445107
2-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]propanamide
CID 61274113
2-phenyl-3-pyridin-4-yl-N-(pyridin-2-ylmethyl)propanamide
CID 110410530
N-[2-(cyclopropylamino)-2-oxoethyl]-2-phenyl-3-pyridin-4-ylpropanamide
CID 110625050
N-[2-(2,3-dihydroindol-1-yl)ethyl]-5-phenylpentanamide
CID 110301318
(3S)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 97191213

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
The IUPAC name of N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide (CID 110620139) is N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide.
What is the SMILES notation for N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
The canonical SMILES for N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide is O=C(NCCN1CCc2ccccc21)C(Cc1ccncc1)c1ccccc1.
What is the InChIKey of N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
The InChIKey is JIADAIVMMOCUQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O/c28-24(26-15-17-27-16-12-21-8-4-5-9-23(21)27)22(20-6-2-1-3-7-20)18-19-10-13-25-14-11-19/h1-11,13-14,22H,12,15-18H2,(H,26,28).
What are the key properties of N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide?
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide has a molecular weight of 371.48 g/mol, XLogP of 3.59, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-phenyl-3-pyridin-4-ylpropanamide is sourced from PubChem (CID 110620139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).