8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine

C14H26N2 — CID 107415395

IUPAC8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
SMILESCC1CCC(CN2C3CCC2CC(N)C3)C1
InChIInChI=1S/C14H26N2/c1-10-2-3-11(6-10)9-16-13-4-5-14(16)8-12(15)7-13/h10-14H,2-9,15H2,1H3
InChIKeyVFEOVGRXRNNEKJ-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.38
Rot. Bonds2

About 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine

8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 107415395) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound Name8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID107415395
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine
SMILESCC1CCC(CN2C3CCC2CC(N)C3)C1
InChIInChI=1S/C14H26N2/c1-10-2-3-11(6-10)9-16-13-4-5-14(16)8-12(15)7-13/h10-14H,2-9,15H2,1H3
InChIKeyVFEOVGRXRNNEKJ-UHFFFAOYSA-N
XLogP2.38
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine (CID 107415395) is 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine is CC1CCC(CN2C3CCC2CC(N)C3)C1.
What is the InChIKey of 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is VFEOVGRXRNNEKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-10-2-3-11(6-10)9-16-13-4-5-14(16)8-12(15)7-13/h10-14H,2-9,15H2,1H3.
What are the key properties of 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine?
8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 222.38 g/mol, XLogP of 2.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(3-methylcyclopentyl)methyl]-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 107415395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).