1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine

C18H29N — CID 25134594

IUPAC1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine
SMILESCC(N)C12CC3C4CC5CC(C(C1)C3(C)C5)C4(C)C2
InChIInChI=1S/C18H29N/c1-10(19)18-7-14-12-4-11-5-13(17(12,3)9-18)15(8-18)16(14,2)6-11/h10-15H,4-9,19H2,1-3H3
InChIKeyVZKONEYYUIPRNP-UHFFFAOYSA-N
MW259.44 g/mol
LogP3.82
Rot. Bonds1

About 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine

1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine (PubChem CID 25134594) has the molecular formula C18H29N and a molecular weight of 259.44 g/mol. Its IUPAC name is 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine.

Molecular Properties

Compound Name1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine
PubChem CID25134594
Molecular FormulaC18H29N
Molecular Weight259.44 g/mol
Exact Mass259.23
IUPAC Name1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine
SMILESCC(N)C12CC3C4CC5CC(C(C1)C3(C)C5)C4(C)C2
InChIInChI=1S/C18H29N/c1-10(19)18-7-14-12-4-11-5-13(17(12,3)9-18)15(8-18)16(14,2)6-11/h10-15H,4-9,19H2,1-3H3
InChIKeyVZKONEYYUIPRNP-UHFFFAOYSA-N
XLogP3.82
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.44
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)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 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine?
The IUPAC name of 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine (CID 25134594) is 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine.
What is the SMILES notation for 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine?
The canonical SMILES for 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine is CC(N)C12CC3C4CC5CC(C(C1)C3(C)C5)C4(C)C2.
What is the InChIKey of 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine?
The InChIKey is VZKONEYYUIPRNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N/c1-10(19)18-7-14-12-4-11-5-13(17(12,3)9-18)15(8-18)16(14,2)6-11/h10-15H,4-9,19H2,1-3H3.
What are the key properties of 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine?
1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine has a molecular weight of 259.44 g/mol, XLogP of 3.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,6-dimethyl-4-pentacyclo[7.3.1.14,12.02,7.06,11]tetradecanyl)ethanamine is sourced from PubChem (CID 25134594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).