[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate

C19H16FNO3 — CID 175568006

IUPAC[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate
SMILESNC(=O)OCc1c(OCc2ccc(F)cc2)ccc2ccccc12
InChIInChI=1S/C19H16FNO3/c20-15-8-5-13(6-9-15)11-23-18-10-7-14-3-1-2-4-16(14)17(18)12-24-19(21)22/h1-10H,11-12H2,(H2,21,22)
InChIKeyIUIWEEYDPQHMOC-UHFFFAOYSA-N
MW325.34 g/mol
LogP4.15
Rot. Bonds5

About [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate

[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate (PubChem CID 175568006) has the molecular formula C19H16FNO3 and a molecular weight of 325.34 g/mol. Its IUPAC name is [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate.

Molecular Properties

Compound Name[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate
PubChem CID175568006
Molecular FormulaC19H16FNO3
Molecular Weight325.34 g/mol
Exact Mass325.11
IUPAC Name[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate
SMILESNC(=O)OCc1c(OCc2ccc(F)cc2)ccc2ccccc12
InChIInChI=1S/C19H16FNO3/c20-15-8-5-13(6-9-15)11-23-18-10-7-14-3-1-2-4-16(14)17(18)12-24-19(21)22/h1-10H,11-12H2,(H2,21,22)
InChIKeyIUIWEEYDPQHMOC-UHFFFAOYSA-N
XLogP4.15
TPSA61.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methanol
CID 964391
4-[[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methylazaniumyl]methyl]benzoate
CID 27185359
1-(3-bromopropyl)-2-[(4-fluorophenyl)methoxy]naphthalene
CID 171486262
N-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl]-2H-tetrazol-5-amine
CID 834197
(4-fluorophenyl)methyl 1-hydroxynaphthalene-2-carboxylate
CID 957131
N-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl]-2-phenylethanamine
CID 4715865
2-[(4-fluorophenyl)methoxy]phenol
CID 43143460
N-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl]-3-methylbutan-1-amine
CID 17210543
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl-(pyridin-3-ylmethyl)azanium chloride
CID 44665886
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl-(pyridin-2-ylmethyl)azanium chloride
CID 44663912
N-[[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl]-4-phenoxyaniline
CID 126119075
[2-[(3-fluorophenyl)methoxy]naphthalen-1-yl]methanamine
CID 43505452

Frequently Asked Questions

What is the IUPAC name of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate?
The IUPAC name of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate (CID 175568006) is [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate.
What is the SMILES notation for [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate?
The canonical SMILES for [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate is NC(=O)OCc1c(OCc2ccc(F)cc2)ccc2ccccc12.
What is the InChIKey of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate?
The InChIKey is IUIWEEYDPQHMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO3/c20-15-8-5-13(6-9-15)11-23-18-10-7-14-3-1-2-4-16(14)17(18)12-24-19(21)22/h1-10H,11-12H2,(H2,21,22).
What are the key properties of [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate?
[2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate has a molecular weight of 325.34 g/mol, XLogP of 4.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-fluorophenyl)methoxy]naphthalen-1-yl]methyl carbamate is sourced from PubChem (CID 175568006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).