1-(1-adamantyl)-N-ethylethanamine

C14H25N — CID 3725133

IUPAC1-(1-adamantyl)-N-ethylethanamine
SMILESCCNC(C)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25N/c1-3-15-10(2)14-7-11-4-12(8-14)6-13(5-11)9-14/h10-13,15H,3-9H2,1-2H3
InChIKeyGLDFVSWZLHGRPN-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.20
Rot. Bonds3

About 1-(1-adamantyl)-N-ethylethanamine

1-(1-adamantyl)-N-ethylethanamine (PubChem CID 3725133) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 1-(1-adamantyl)-N-ethylethanamine.

Molecular Properties

Compound Name1-(1-adamantyl)-N-ethylethanamine
PubChem CID3725133
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name1-(1-adamantyl)-N-ethylethanamine
SMILESCCNC(C)C12CC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25N/c1-3-15-10(2)14-7-11-4-12(8-14)6-13(5-11)9-14/h10-13,15H,3-9H2,1-2H3
InChIKeyGLDFVSWZLHGRPN-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(1-adamantyl)-N-ethylethanamine?
The IUPAC name of 1-(1-adamantyl)-N-ethylethanamine (CID 3725133) is 1-(1-adamantyl)-N-ethylethanamine.
What is the SMILES notation for 1-(1-adamantyl)-N-ethylethanamine?
The canonical SMILES for 1-(1-adamantyl)-N-ethylethanamine is CCNC(C)C12CC3CC(CC(C3)C1)C2.
What is the InChIKey of 1-(1-adamantyl)-N-ethylethanamine?
The InChIKey is GLDFVSWZLHGRPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-3-15-10(2)14-7-11-4-12(8-14)6-13(5-11)9-14/h10-13,15H,3-9H2,1-2H3.
What are the key properties of 1-(1-adamantyl)-N-ethylethanamine?
1-(1-adamantyl)-N-ethylethanamine has a molecular weight of 207.36 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-adamantyl)-N-ethylethanamine is sourced from PubChem (CID 3725133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).