N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine

C14H21N — CID 71344847

IUPACN,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCCN(CC)c1cccc2c1CCCC2
InChIInChI=1S/C14H21N/c1-3-15(4-2)14-11-7-9-12-8-5-6-10-13(12)14/h7,9,11H,3-6,8,10H2,1-2H3
InChIKeyCQXZBMNYDQJMDZ-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.41
Rot. Bonds3

About N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine

N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine (PubChem CID 71344847) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine.

Molecular Properties

Compound NameN,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine
PubChem CID71344847
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC NameN,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine
SMILESCCN(CC)c1cccc2c1CCCC2
InChIInChI=1S/C14H21N/c1-3-15(4-2)14-11-7-9-12-8-5-6-10-13(12)14/h7,9,11H,3-6,8,10H2,1-2H3
InChIKeyCQXZBMNYDQJMDZ-UHFFFAOYSA-N
XLogP3.41
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine?
The IUPAC name of N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine (CID 71344847) is N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine.
What is the SMILES notation for N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine?
The canonical SMILES for N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine is CCN(CC)c1cccc2c1CCCC2.
What is the InChIKey of N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine?
The InChIKey is CQXZBMNYDQJMDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-15(4-2)14-11-7-9-12-8-5-6-10-13(12)14/h7,9,11H,3-6,8,10H2,1-2H3.
What are the key properties of N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine?
N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.41, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5,6,7,8-tetrahydronaphthalen-1-amine is sourced from PubChem (CID 71344847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).