tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate

C19H23NO2 — CID 142472908

IUPACtert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate
SMILESC=Cc1c(CCNC(=O)OC(C)(C)C)ccc2ccccc12
InChIInChI=1S/C19H23NO2/c1-5-16-15(11-10-14-8-6-7-9-17(14)16)12-13-20-18(21)22-19(2,3)4/h5-11H,1,12-13H2,2-4H3,(H,20,21)
InChIKeyWLMWTJYWVAYGAX-UHFFFAOYSA-N
MW297.40 g/mol
LogP4.55
Rot. Bonds4

About tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate

tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate (PubChem CID 142472908) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate
PubChem CID142472908
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Nametert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate
SMILESC=Cc1c(CCNC(=O)OC(C)(C)C)ccc2ccccc12
InChIInChI=1S/C19H23NO2/c1-5-16-15(11-10-14-8-6-7-9-17(14)16)12-13-20-18(21)22-19(2,3)4/h5-11H,1,12-13H2,2-4H3,(H,20,21)
InChIKeyWLMWTJYWVAYGAX-UHFFFAOYSA-N
XLogP4.55
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]naphthalene-1-carboxylic acid
CID 69452864
tert-butyl N-[2-(3-bromonaphthalen-2-yl)ethyl]carbamate
CID 142472839
tert-butyl N-[2-[2-(2-hydroxyethyl)phenyl]ethyl]carbamate
CID 141182923
tert-butyl N-[3-(2-ethoxynaphthalen-1-yl)prop-2-enyl]carbamate
CID 169468647
tert-butyl N-(2-phenylethyl)carbamate;ethane
CID 177159157
[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]phenyl] methanesulfonate
CID 175577390
tert-butyl N-[2-(1-ethylnaphthalen-2-yl)oxyethyl]carbamate
CID 86709756
tert-butyl N-[2-[2-[(E,4S)-4-hydroxypent-2-en-2-yl]phenyl]ethyl]carbamate
CID 102483419
tert-butyl N-[[4-(formamidomethyl)naphthalen-1-yl]methyl]carbamate
CID 140632383
tert-butyl N-[2-[2-(2-chlorophenyl)ethylcarbamoylamino]ethyl]carbamate
CID 108864598
tert-butyl N-[(2-hydroxynaphthalen-1-yl)methylideneamino]carbamate
CID 2692498
tert-butyl N-[2-(3,4-dimethoxy-2-methylphenyl)ethyl]carbamate
CID 142979716

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate?
The IUPAC name of tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate (CID 142472908) is tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate.
What is the SMILES notation for tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate?
The canonical SMILES for tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate is C=Cc1c(CCNC(=O)OC(C)(C)C)ccc2ccccc12.
What is the InChIKey of tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate?
The InChIKey is WLMWTJYWVAYGAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-5-16-15(11-10-14-8-6-7-9-17(14)16)12-13-20-18(21)22-19(2,3)4/h5-11H,1,12-13H2,2-4H3,(H,20,21).
What are the key properties of tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate?
tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate has a molecular weight of 297.40 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[2-(1-ethenylnaphthalen-2-yl)ethyl]carbamate is sourced from PubChem (CID 142472908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).