N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine

C20H31N — CID 66477249

IUPACN-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
SMILESCCNC(c1ccc2c(c1)CCCC2)C1C(C)(C)C1(C)C
InChIInChI=1S/C20H31N/c1-6-21-17(18-19(2,3)20(18,4)5)16-12-11-14-9-7-8-10-15(14)13-16/h11-13,17-18,21H,6-10H2,1-5H3
InChIKeyNGWZPMIRMHBVII-UHFFFAOYSA-N
MW285.48 g/mol
LogP4.90
Rot. Bonds4

About N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine

N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine (PubChem CID 66477249) has the molecular formula C20H31N and a molecular weight of 285.48 g/mol. Its IUPAC name is N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
PubChem CID66477249
Molecular FormulaC20H31N
Molecular Weight285.48 g/mol
Exact Mass285.25
IUPAC NameN-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine
SMILESCCNC(c1ccc2c(c1)CCCC2)C1C(C)(C)C1(C)C
InChIInChI=1S/C20H31N/c1-6-21-17(18-19(2,3)20(18,4)5)16-12-11-14-9-7-8-10-15(14)13-16/h11-13,17-18,21H,6-10H2,1-5H3
InChIKeyNGWZPMIRMHBVII-UHFFFAOYSA-N
XLogP4.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.48
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine?
The IUPAC name of N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine (CID 66477249) is N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine.
What is the SMILES notation for N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine?
The canonical SMILES for N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine is CCNC(c1ccc2c(c1)CCCC2)C1C(C)(C)C1(C)C.
What is the InChIKey of N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine?
The InChIKey is NGWZPMIRMHBVII-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H31N/c1-6-21-17(18-19(2,3)20(18,4)5)16-12-11-14-9-7-8-10-15(14)13-16/h11-13,17-18,21H,6-10H2,1-5H3.
What are the key properties of N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine?
N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine has a molecular weight of 285.48 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5,6,7,8-tetrahydronaphthalen-2-yl-(2,2,3,3-tetramethylcyclopropyl)methyl]ethanamine is sourced from PubChem (CID 66477249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).