2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine

C14H25N — CID 3010150

IUPAC2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine
SMILESCC(C)(N)C12CCC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25N/c1-13(2,15)14-4-3-10-5-11(8-14)7-12(6-10)9-14/h10-12H,3-9,15H2,1-2H3
InChIKeyYGXGHCCKIKWTBQ-UHFFFAOYSA-N
MW207.36 g/mol
LogP3.33
Rot. Bonds1

About 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine

2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine (PubChem CID 3010150) has the molecular formula C14H25N and a molecular weight of 207.36 g/mol. Its IUPAC name is 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine.

Molecular Properties

Compound Name2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine
PubChem CID3010150
Molecular FormulaC14H25N
Molecular Weight207.36 g/mol
Exact Mass207.20
IUPAC Name2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine
SMILESCC(C)(N)C12CCC3CC(CC(C3)C1)C2
InChIInChI=1S/C14H25N/c1-13(2,15)14-4-3-10-5-11(8-14)7-12(6-10)9-14/h10-12H,3-9,15H2,1-2H3
InChIKeyYGXGHCCKIKWTBQ-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.36
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine?
The IUPAC name of 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine (CID 3010150) is 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine.
What is the SMILES notation for 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine?
The canonical SMILES for 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine is CC(C)(N)C12CCC3CC(CC(C3)C1)C2.
What is the InChIKey of 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine?
The InChIKey is YGXGHCCKIKWTBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N/c1-13(2,15)14-4-3-10-5-11(8-14)7-12(6-10)9-14/h10-12H,3-9,15H2,1-2H3.
What are the key properties of 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine?
2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine has a molecular weight of 207.36 g/mol, XLogP of 3.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-tricyclo[4.3.1.13,8]undecanyl)propan-2-amine is sourced from PubChem (CID 3010150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).