N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine

C18H21N — CID 155323115

IUPACN,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
SMILESCC1CCCc2cc(N(C)c3ccccc3)ccc21
InChIInChI=1S/C18H21N/c1-14-7-6-8-15-13-17(11-12-18(14)15)19(2)16-9-4-3-5-10-16/h3-5,9-14H,6-8H2,1-2H3
InChIKeyFIMHHLMYEVSSNN-UHFFFAOYSA-N
MW251.37 g/mol
LogP4.89
Rot. Bonds2

About N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine

N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine (PubChem CID 155323115) has the molecular formula C18H21N and a molecular weight of 251.37 g/mol. Its IUPAC name is N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
PubChem CID155323115
Molecular FormulaC18H21N
Molecular Weight251.37 g/mol
Exact Mass251.17
IUPAC NameN,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine
SMILESCC1CCCc2cc(N(C)c3ccccc3)ccc21
InChIInChI=1S/C18H21N/c1-14-7-6-8-15-13-17(11-12-18(14)15)19(2)16-9-4-3-5-10-16/h3-5,9-14H,6-8H2,1-2H3
InChIKeyFIMHHLMYEVSSNN-UHFFFAOYSA-N
XLogP4.89
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
The IUPAC name of N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine (CID 155323115) is N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
The canonical SMILES for N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine is CC1CCCc2cc(N(C)c3ccccc3)ccc21.
What is the InChIKey of N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
The InChIKey is FIMHHLMYEVSSNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N/c1-14-7-6-8-15-13-17(11-12-18(14)15)19(2)16-9-4-3-5-10-16/h3-5,9-14H,6-8H2,1-2H3.
What are the key properties of N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine?
N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine has a molecular weight of 251.37 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-phenyl-5,6,7,8-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 155323115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).