N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide

C24H23NO — CID 17148227

IUPACN-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide
SMILESO=C(Nc1ccc2c3c(cccc13)CC2)C1(c2ccccc2)CCCC1
InChIInChI=1S/C24H23NO/c26-23(24(15-4-5-16-24)19-8-2-1-3-9-19)25-21-14-13-18-12-11-17-7-6-10-20(21)22(17)18/h1-3,6-10,13-14H,4-5,11-12,15-16H2,(H,25,26)
InChIKeyFIRPRCNMMPGMBY-UHFFFAOYSA-N
MW341.45 g/mol
LogP5.39
Rot. Bonds3

About N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide

N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide (PubChem CID 17148227) has the molecular formula C24H23NO and a molecular weight of 341.45 g/mol. Its IUPAC name is N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide
PubChem CID17148227
Molecular FormulaC24H23NO
Molecular Weight341.45 g/mol
Exact Mass341.18
IUPAC NameN-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide
SMILESO=C(Nc1ccc2c3c(cccc13)CC2)C1(c2ccccc2)CCCC1
InChIInChI=1S/C24H23NO/c26-23(24(15-4-5-16-24)19-8-2-1-3-9-19)25-21-14-13-18-12-11-17-7-6-10-20(21)22(17)18/h1-3,6-10,13-14H,4-5,11-12,15-16H2,(H,25,26)
InChIKeyFIRPRCNMMPGMBY-UHFFFAOYSA-N
XLogP5.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.45
LogP ≤ 55.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-naphthalen-1-yl-1-phenylcyclobutane-1-carboxamide
CID 32618502
N-[4-(2-methylpropoxy)naphthalen-1-yl]-1-phenylcyclopentane-1-carboxamide
CID 100719168
2-[(1-phenylcyclopentanecarbonyl)amino]benzamide
CID 28624302
N-(4-methoxynaphthalen-1-yl)-1-phenylcyclopropane-1-carboxamide
CID 100782309
2-benzylsulfanyl-N-(1,2-dihydroacenaphthylen-5-yl)acetamide
CID 800367
N-(2,6-difluorophenyl)-1-phenylcyclobutane-1-carboxamide
CID 110438554
N-(8-methoxyquinolin-5-yl)-1-phenylcyclohexane-1-carboxamide
CID 100770558
N-(5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-yl)-1-phenylcyclobutane-1-carboxamide
CID 120883808
N-(1,2-dihydroacenaphthylen-5-yl)thiophene-2-carboxamide
CID 881818
N-(2-nitrophenyl)-1-phenylcyclopentane-1-carboxamide
CID 2877363
1-phenyl-N-quinolin-8-ylcyclopentane-1-carboxamide
CID 17027296
N-(2-chloro-6-methylphenyl)-1-phenylcyclopentane-1-carboxamide
CID 4060747

Frequently Asked Questions

What is the IUPAC name of N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide?
The IUPAC name of N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide (CID 17148227) is N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide?
The canonical SMILES for N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide is O=C(Nc1ccc2c3c(cccc13)CC2)C1(c2ccccc2)CCCC1.
What is the InChIKey of N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide?
The InChIKey is FIRPRCNMMPGMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO/c26-23(24(15-4-5-16-24)19-8-2-1-3-9-19)25-21-14-13-18-12-11-17-7-6-10-20(21)22(17)18/h1-3,6-10,13-14H,4-5,11-12,15-16H2,(H,25,26).
What are the key properties of N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide?
N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide has a molecular weight of 341.45 g/mol, XLogP of 5.39, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dihydroacenaphthylen-5-yl)-1-phenylcyclopentane-1-carboxamide is sourced from PubChem (CID 17148227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).