[6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate

C20H23NO2 — CID 175568904

IUPAC[6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
SMILESCC(C)c1cccc(-c2ccc3c(c2)CCCC3OC(N)=O)c1
InChIInChI=1S/C20H23NO2/c1-13(2)14-5-3-6-15(11-14)16-9-10-18-17(12-16)7-4-8-19(18)23-20(21)22/h3,5-6,9-13,19H,4,7-8H2,1-2H3,(H2,21,22)
InChIKeyMHIQVJVCGMYUJT-UHFFFAOYSA-N
MW309.41 g/mol
LogP4.95
Rot. Bonds3

About [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate

[6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate (PubChem CID 175568904) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate.

Molecular Properties

Compound Name[6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
PubChem CID175568904
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name[6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
SMILESCC(C)c1cccc(-c2ccc3c(c2)CCCC3OC(N)=O)c1
InChIInChI=1S/C20H23NO2/c1-13(2)14-5-3-6-15(11-14)16-9-10-18-17(12-16)7-4-8-19(18)23-20(21)22/h3,5-6,9-13,19H,4,7-8H2,1-2H3,(H2,21,22)
InChIKeyMHIQVJVCGMYUJT-UHFFFAOYSA-N
XLogP4.95
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[6-(3-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
CID 175568925
[6-(2,3-difluorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
CID 175568706
[6-[2-(2-methoxyethoxy)phenyl]-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
CID 175568722
[6-(2,4-difluorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
CID 175568957
[7-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate
CID 175568823
[5-(3,5-difluorophenyl)-2,3-dihydro-1H-inden-1-yl] carbamate
CID 175296693
[(1S)-2,2-dimethyl-6-(3-propan-2-ylphenyl)-3,4-dihydro-1H-naphthalen-1-yl]carbamic acid
CID 174226543
1,2,3,4-tetrahydronaphthalen-1-yl 4-amino-3-methylbutanoate
CID 81072196
[7-(3-tert-butylphenyl)-3,4-dihydro-2H-chromen-4-yl] carbamate
CID 175254109
5-(3-propan-2-ylphenyl)pyridine-2-carboxamide
CID 123211569
6-phenyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 126542656
[7-(3-fluorophenyl)-3,4-dihydro-2H-chromen-4-yl] carbamate
CID 175253063

Frequently Asked Questions

What is the IUPAC name of [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate?
The IUPAC name of [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate (CID 175568904) is [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate.
What is the SMILES notation for [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate?
The canonical SMILES for [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate is CC(C)c1cccc(-c2ccc3c(c2)CCCC3OC(N)=O)c1.
What is the InChIKey of [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate?
The InChIKey is MHIQVJVCGMYUJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c1-13(2)14-5-3-6-15(11-14)16-9-10-18-17(12-16)7-4-8-19(18)23-20(21)22/h3,5-6,9-13,19H,4,7-8H2,1-2H3,(H2,21,22).
What are the key properties of [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate?
[6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate has a molecular weight of 309.41 g/mol, XLogP of 4.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-propan-2-ylphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl] carbamate is sourced from PubChem (CID 175568904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).