cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate

C19H21FN2O3 — CID 25030692

IUPACcyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate
SMILESNc1cc(OCc2ccc(F)cc2)ccc1NC(=O)OC1CCCC1
InChIInChI=1S/C19H21FN2O3/c20-14-7-5-13(6-8-14)12-24-16-9-10-18(17(21)11-16)22-19(23)25-15-3-1-2-4-15/h5-11,15H,1-4,12,21H2,(H,22,23)
InChIKeyZANZWVPQJYDBIO-UHFFFAOYSA-N
MW344.39 g/mol
LogP4.48
Rot. Bonds5

About cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate

cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate (PubChem CID 25030692) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate.

Molecular Properties

Compound Namecyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate
PubChem CID25030692
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Namecyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate
SMILESNc1cc(OCc2ccc(F)cc2)ccc1NC(=O)OC1CCCC1
InChIInChI=1S/C19H21FN2O3/c20-14-7-5-13(6-8-14)12-24-16-9-10-18(17(21)11-16)22-19(23)25-15-3-1-2-4-15/h5-11,15H,1-4,12,21H2,(H,22,23)
InChIKeyZANZWVPQJYDBIO-UHFFFAOYSA-N
XLogP4.48
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

propan-2-yl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate
CID 25030471
cyclopentyl N-(2,4-difluorophenyl)carbamate
CID 113218545
cyclohexyl N-[2-amino-6-[(4-fluorophenyl)methylamino]-3-pyridinyl]carbamate
CID 110186504
cyclopentyl N-[2-(aminomethyl)-3-fluorophenyl]carbamate
CID 112738527
N-[[4-[(4-fluorophenoxy)methyl]phenyl]methyl]cyclopropanamine
CID 62454139
2-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]cyclohexan-1-amine
CID 82185958
cyclohexyl 4,5-difluoro-2-(naphthalen-2-ylmethoxycarbonylamino)benzoate
CID 169223474
(4-fluorophenyl)methyl N-aminocarbamate
CID 131187793
[(1S,3R)-3-[[2-(4-fluorophenyl)acetyl]amino]cyclohexyl] N-phenylcarbamate
CID 95985787
3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
CID 91686884
(2S)-N-[3-[(4-fluorophenyl)methoxy]phenyl]-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 111104603
(4-fluorophenyl)methyl 2-(4-aminophenoxy)acetate
CID 61321388

Frequently Asked Questions

What is the IUPAC name of cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate?
The IUPAC name of cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate (CID 25030692) is cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate.
What is the SMILES notation for cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate?
The canonical SMILES for cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate is Nc1cc(OCc2ccc(F)cc2)ccc1NC(=O)OC1CCCC1.
What is the InChIKey of cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate?
The InChIKey is ZANZWVPQJYDBIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c20-14-7-5-13(6-8-14)12-24-16-9-10-18(17(21)11-16)22-19(23)25-15-3-1-2-4-15/h5-11,15H,1-4,12,21H2,(H,22,23).
What are the key properties of cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate?
cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate has a molecular weight of 344.39 g/mol, XLogP of 4.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl N-[2-amino-4-[(4-fluorophenyl)methoxy]phenyl]carbamate is sourced from PubChem (CID 25030692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).