N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide

C21H24N2O — CID 19846169

IUPACN-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide
SMILESO=C(CN1CCCC1)NC1(c2ccccc2)Cc2ccccc2C1
InChIInChI=1S/C21H24N2O/c24-20(16-23-12-6-7-13-23)22-21(19-10-2-1-3-11-19)14-17-8-4-5-9-18(17)15-21/h1-5,8-11H,6-7,12-16H2,(H,22,24)
InChIKeyNQCWRIHQNBMYKS-UHFFFAOYSA-N
MW320.44 g/mol
LogP2.89
Rot. Bonds4

About N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide

N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide (PubChem CID 19846169) has the molecular formula C21H24N2O and a molecular weight of 320.44 g/mol. Its IUPAC name is N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide
PubChem CID19846169
Molecular FormulaC21H24N2O
Molecular Weight320.44 g/mol
Exact Mass320.19
IUPAC NameN-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide
SMILESO=C(CN1CCCC1)NC1(c2ccccc2)Cc2ccccc2C1
InChIInChI=1S/C21H24N2O/c24-20(16-23-12-6-7-13-23)22-21(19-10-2-1-3-11-19)14-17-8-4-5-9-18(17)15-21/h1-5,8-11H,6-7,12-16H2,(H,22,24)
InChIKeyNQCWRIHQNBMYKS-UHFFFAOYSA-N
XLogP2.89
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-oxo-2-[(1-phenylcyclobutyl)amino]ethyl]piperidine-4-carboxylic acid
CID 119907979
2-[(3R)-3-hydroxypiperidin-1-yl]-N-(4-phenyloxan-4-yl)acetamide
CID 125446924
N-[(1-phenylcyclopentyl)methyl]-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 44667750
N-[(1-phenylcyclopentyl)methyl]-2-piperidin-1-ylacetamide chloride
CID 53347611
2-[3-(aminomethyl)-3-methylpyrrolidin-1-yl]-N-(1-phenylcyclobutyl)acetamide;hydrochloride
CID 120772746
2-amino-N-(2-phenyl-1,3-dihydroinden-2-yl)propanamide
CID 19846148
N,N'-bis(1-phenylcyclopropyl)propanediamide
CID 166301287
N-[1-[2-oxo-2-[(1-phenylcyclobutyl)amino]ethyl]piperidin-4-yl]thiophene-3-carboxamide
CID 86842848
2-(azocan-1-yl)-N-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 25435064
(2R)-1-[2-oxo-2-[(1-phenylcyclobutyl)amino]ethyl]pyrrolidine-2-carboxylic acid
CID 119914227
N-(4-oxo-6,9-diphenyl-3-azabicyclo[3.2.2]nonan-1-yl)-2-pyrrolidin-1-ylacetamide
CID 67041803
2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)acetohydrazide
CID 63573779

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide (CID 19846169) is N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide is O=C(CN1CCCC1)NC1(c2ccccc2)Cc2ccccc2C1.
What is the InChIKey of N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide?
The InChIKey is NQCWRIHQNBMYKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O/c24-20(16-23-12-6-7-13-23)22-21(19-10-2-1-3-11-19)14-17-8-4-5-9-18(17)15-21/h1-5,8-11H,6-7,12-16H2,(H,22,24).
What are the key properties of N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide?
N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide has a molecular weight of 320.44 g/mol, XLogP of 2.89, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-1,3-dihydroinden-2-yl)-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 19846169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).