tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate

C19H29NO2 — CID 91156765

IUPACtert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate
SMILESCCc1cccc2c1CC(CC)(NC(=O)OC(C)(C)C)CC2
InChIInChI=1S/C19H29NO2/c1-6-14-9-8-10-15-11-12-19(7-2,13-16(14)15)20-17(21)22-18(3,4)5/h8-10H,6-7,11-13H2,1-5H3,(H,20,21)
InChIKeyHCSQEKPWYNHIOH-UHFFFAOYSA-N
MW303.45 g/mol
LogP4.41
Rot. Bonds3

About tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate

tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate (PubChem CID 91156765) has the molecular formula C19H29NO2 and a molecular weight of 303.45 g/mol. Its IUPAC name is tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate
PubChem CID91156765
Molecular FormulaC19H29NO2
Molecular Weight303.45 g/mol
Exact Mass303.22
IUPAC Nametert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate
SMILESCCc1cccc2c1CC(CC)(NC(=O)OC(C)(C)C)CC2
InChIInChI=1S/C19H29NO2/c1-6-14-9-8-10-15-11-12-19(7-2,13-16(14)15)20-17(21)22-18(3,4)5/h8-10H,6-7,11-13H2,1-5H3,(H,20,21)
InChIKeyHCSQEKPWYNHIOH-UHFFFAOYSA-N
XLogP4.41
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-amino-5-bromo-3,4-dihydro-1H-naphthalen-2-yl)ethanol;tert-butyl N-[5-bromo-2-(2-hydroxyethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbamate
CID 159010200
dimethyl 7,15-bis[(2-methylpropan-2-yl)oxycarbonylamino]tetracyclo[7.7.2.05,17.013,18]octadeca-1(17),2,4,9,11,13(18)-hexaene-7,15-dicarboxylate
CID 100949582
tert-butyl N-[2-(5-amino-2-ethylphenyl)-1,3-dihydroinden-2-yl]carbamate
CID 18331441
tert-butyl N-[(1S)-1-(3,3-dimethylpentyl)-3-oxocyclopentyl]carbamate
CID 130272438
1-[(2-methylpropan-2-yl)oxycarbonylamino]-2,3-dihydroindene-1-carboxylic acid
CID 2733195
tert-butyl N-[(8-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl)methyl]carbamate
CID 58242220
methyl (2R)-8-[(2S)-3-(ethylamino)-2-methylpropoxy]-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3,4-dihydro-1H-naphthalene-2-carboxylate
CID 131720950
tert-butyl N-[1-[[(2,6-dimethylphenyl)methylamino]methyl]cyclobutyl]carbamate
CID 107243378
tert-butyl N-(3-ethylpiperidin-3-yl)carbamate
CID 84726051
tert-butyl N-(2-cyano-1,3-dihydroinden-2-yl)carbamate
CID 164650703
tert-butyl N-[1-(phenylmethoxymethyl)cyclopropyl]carbamate
CID 10934734
tert-butyl N-(1-carbamoyl-2,3-dihydroinden-1-yl)carbamate
CID 91387270

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate?
The IUPAC name of tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate (CID 91156765) is tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate.
What is the SMILES notation for tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate?
The canonical SMILES for tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate is CCc1cccc2c1CC(CC)(NC(=O)OC(C)(C)C)CC2.
What is the InChIKey of tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate?
The InChIKey is HCSQEKPWYNHIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29NO2/c1-6-14-9-8-10-15-11-12-19(7-2,13-16(14)15)20-17(21)22-18(3,4)5/h8-10H,6-7,11-13H2,1-5H3,(H,20,21).
What are the key properties of tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate?
tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate has a molecular weight of 303.45 g/mol, XLogP of 4.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(2,8-diethyl-3,4-dihydro-1H-naphthalen-2-yl)carbamate is sourced from PubChem (CID 91156765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).