1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine

C10H18N2 — CID 18937849

IUPAC1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine
SMILESNCC1C2CC3CC(C2)CN1C3
InChIInChI=1S/C10H18N2/c11-4-10-9-2-7-1-8(3-9)6-12(10)5-7/h7-10H,1-6,11H2
InChIKeyGAXRSARCPXSVLH-UHFFFAOYSA-N
MW166.27 g/mol
LogP0.68
Rot. Bonds1

About 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine

1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine (PubChem CID 18937849) has the molecular formula C10H18N2 and a molecular weight of 166.27 g/mol. Its IUPAC name is 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine.

Molecular Properties

Compound Name1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine
PubChem CID18937849
Molecular FormulaC10H18N2
Molecular Weight166.27 g/mol
Exact Mass166.15
IUPAC Name1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine
SMILESNCC1C2CC3CC(C2)CN1C3
InChIInChI=1S/C10H18N2/c11-4-10-9-2-7-1-8(3-9)6-12(10)5-7/h7-10H,1-6,11H2
InChIKeyGAXRSARCPXSVLH-UHFFFAOYSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.27
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine?
The IUPAC name of 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine (CID 18937849) is 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine.
What is the SMILES notation for 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine?
The canonical SMILES for 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine is NCC1C2CC3CC(C2)CN1C3.
What is the InChIKey of 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine?
The InChIKey is GAXRSARCPXSVLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2/c11-4-10-9-2-7-1-8(3-9)6-12(10)5-7/h7-10H,1-6,11H2.
What are the key properties of 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine?
1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine has a molecular weight of 166.27 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-azatricyclo[3.3.1.13,7]decan-2-ylmethanamine is sourced from PubChem (CID 18937849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).