azane;1,2-di(propan-2-yl)naphthalene

C16H23N — CID 172719874

IUPACazane;1,2-di(propan-2-yl)naphthalene
SMILESCC(C)c1ccc2ccccc2c1C(C)C.N
InChIInChI=1S/C16H20.H3N/c1-11(2)14-10-9-13-7-5-6-8-15(13)16(14)12(3)4;/h5-12H,1-4H3;1H3
InChIKeyGJAAHLVTTPASQY-UHFFFAOYSA-N
MW229.37 g/mol
LogP5.25
Rot. Bonds2

About azane;1,2-di(propan-2-yl)naphthalene

azane;1,2-di(propan-2-yl)naphthalene (PubChem CID 172719874) has the molecular formula C16H23N and a molecular weight of 229.37 g/mol. Its IUPAC name is azane;1,2-di(propan-2-yl)naphthalene.

Molecular Properties

Compound Nameazane;1,2-di(propan-2-yl)naphthalene
PubChem CID172719874
Molecular FormulaC16H23N
Molecular Weight229.37 g/mol
Exact Mass229.18
IUPAC Nameazane;1,2-di(propan-2-yl)naphthalene
SMILESCC(C)c1ccc2ccccc2c1C(C)C.N
InChIInChI=1S/C16H20.H3N/c1-11(2)14-10-9-13-7-5-6-8-15(13)16(14)12(3)4;/h5-12H,1-4H3;1H3
InChIKeyGJAAHLVTTPASQY-UHFFFAOYSA-N
XLogP5.25
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500229.37
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Naphthalene
CID 931
Benzo[a]pyrene
CID 2336
Anthracene
CID 8418
Phenanthrene
CID 995
Pyrene
CID 31423
1-Methylnaphthalene
CID 7002
BENZ(a)ANTHRACENE
CID 5954
Benzo(ghi)perylene
CID 9117
Benzo(E)Pyrene
CID 9128
Acenaphthylene
CID 9161
Chrysene
CID 9171
7,12-Dimethylbenz(a)anthracene
CID 6001

Frequently Asked Questions

What is the IUPAC name of azane;1,2-di(propan-2-yl)naphthalene?
The IUPAC name of azane;1,2-di(propan-2-yl)naphthalene (CID 172719874) is azane;1,2-di(propan-2-yl)naphthalene.
What is the SMILES notation for azane;1,2-di(propan-2-yl)naphthalene?
The canonical SMILES for azane;1,2-di(propan-2-yl)naphthalene is CC(C)c1ccc2ccccc2c1C(C)C.N.
What is the InChIKey of azane;1,2-di(propan-2-yl)naphthalene?
The InChIKey is GJAAHLVTTPASQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20.H3N/c1-11(2)14-10-9-13-7-5-6-8-15(13)16(14)12(3)4;/h5-12H,1-4H3;1H3.
What are the key properties of azane;1,2-di(propan-2-yl)naphthalene?
azane;1,2-di(propan-2-yl)naphthalene has a molecular weight of 229.37 g/mol, XLogP of 5.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,2-di(propan-2-yl)naphthalene is sourced from PubChem (CID 172719874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).