N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide

C19H14FNO — CID 1301177

IUPACN-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc2c3c(cccc13)CC2
InChIInChI=1S/C19H14FNO/c20-16-6-1-2-7-17(16)21-19(22)15-11-10-13-9-8-12-4-3-5-14(15)18(12)13/h1-7,10-11H,8-9H2,(H,21,22)
InChIKeyLPOSSVCDLBKTMY-UHFFFAOYSA-N
MW291.32 g/mol
LogP4.33
Rot. Bonds2

About N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide

N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide (PubChem CID 1301177) has the molecular formula C19H14FNO and a molecular weight of 291.32 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide
PubChem CID1301177
Molecular FormulaC19H14FNO
Molecular Weight291.32 g/mol
Exact Mass291.11
IUPAC NameN-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc2c3c(cccc13)CC2
InChIInChI=1S/C19H14FNO/c20-16-6-1-2-7-17(16)21-19(22)15-11-10-13-9-8-12-4-3-5-14(15)18(12)13/h1-7,10-11H,8-9H2,(H,21,22)
InChIKeyLPOSSVCDLBKTMY-UHFFFAOYSA-N
XLogP4.33
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.32
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-ethylphenyl)-1,2-dihydroacenaphthylene-5-carboxamide
CID 23877086
N-(3-chloro-2-methylphenyl)-1,2-dihydroacenaphthylene-5-carboxamide
CID 23992050
N-(4-iodophenyl)-1,2-dihydroacenaphthylene-5-carboxamide
CID 23940641
N-(1,2-dihydroacenaphthylen-5-yl)-2,3-dimethoxybenzamide
CID 7533068
N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)-1,2-dihydroacenaphthylene-5-carboxamide
CID 3533198
(2-aminophenyl)-(1,2-dihydroacenaphthylen-5-yl)methanone
CID 114939814
N-(1,2-dihydroacenaphthylen-5-yl)naphthalene-2-carboxamide
CID 5070082
N-[(1S)-1-(2-methoxyphenyl)ethyl]-1,2-dihydroacenaphthylene-5-carboxamide
CID 40817507
N-(1,2-dihydroacenaphthylen-5-yl)-2-fluorobenzenesulfonamide
CID 18125849
(2R)-1-(1,2-dihydroacenaphthylen-5-yl)-2-hydroxy-2-phenylethanone
CID 7053397
2-(1,2-dihydroacenaphthylen-5-ylamino)-N-(2-iodophenyl)acetamide
CID 24562392
4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-fluorophenyl)benzamide
CID 109047920

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide (CID 1301177) is N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide is O=C(Nc1ccccc1F)c1ccc2c3c(cccc13)CC2.
What is the InChIKey of N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide?
The InChIKey is LPOSSVCDLBKTMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FNO/c20-16-6-1-2-7-17(16)21-19(22)15-11-10-13-9-8-12-4-3-5-14(15)18(12)13/h1-7,10-11H,8-9H2,(H,21,22).
What are the key properties of N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide?
N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide has a molecular weight of 291.32 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1,2-dihydroacenaphthylene-5-carboxamide is sourced from PubChem (CID 1301177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).