spiro[adamantane-2,4'-cyclohexane]-1'-amine

C15H25N — CID 51036796

IUPACspiro[adamantane-2,4'-cyclohexane]-1'-amine
SMILESNC1CCC2(CC1)C1CC3CC(C1)CC2C3
InChIInChI=1S/C15H25N/c16-14-1-3-15(4-2-14)12-6-10-5-11(8-12)9-13(15)7-10/h10-14H,1-9,16H2
InChIKeyVNTMIVFMVGTSHV-UHFFFAOYSA-N
MW219.37 g/mol
LogP3.33
Rot. Bonds

About spiro[adamantane-2,4'-cyclohexane]-1'-amine

spiro[adamantane-2,4'-cyclohexane]-1'-amine (PubChem CID 51036796) has the molecular formula C15H25N and a molecular weight of 219.37 g/mol. Its IUPAC name is spiro[adamantane-2,4'-cyclohexane]-1'-amine.

Molecular Properties

Compound Namespiro[adamantane-2,4'-cyclohexane]-1'-amine
PubChem CID51036796
Molecular FormulaC15H25N
Molecular Weight219.37 g/mol
Exact Mass219.20
IUPAC Namespiro[adamantane-2,4'-cyclohexane]-1'-amine
SMILESNC1CCC2(CC1)C1CC3CC(C1)CC2C3
InChIInChI=1S/C15H25N/c16-14-1-3-15(4-2-14)12-6-10-5-11(8-12)9-13(15)7-10/h10-14H,1-9,16H2
InChIKeyVNTMIVFMVGTSHV-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.37
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of spiro[adamantane-2,4'-cyclohexane]-1'-amine?
The IUPAC name of spiro[adamantane-2,4'-cyclohexane]-1'-amine (CID 51036796) is spiro[adamantane-2,4'-cyclohexane]-1'-amine.
What is the SMILES notation for spiro[adamantane-2,4'-cyclohexane]-1'-amine?
The canonical SMILES for spiro[adamantane-2,4'-cyclohexane]-1'-amine is NC1CCC2(CC1)C1CC3CC(C1)CC2C3.
What is the InChIKey of spiro[adamantane-2,4'-cyclohexane]-1'-amine?
The InChIKey is VNTMIVFMVGTSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N/c16-14-1-3-15(4-2-14)12-6-10-5-11(8-12)9-13(15)7-10/h10-14H,1-9,16H2.
What are the key properties of spiro[adamantane-2,4'-cyclohexane]-1'-amine?
spiro[adamantane-2,4'-cyclohexane]-1'-amine has a molecular weight of 219.37 g/mol, XLogP of 3.33, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[adamantane-2,4'-cyclohexane]-1'-amine is sourced from PubChem (CID 51036796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).