1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine

C12H22N2 — CID 130848515

IUPAC1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine
SMILESCNC1(CN2CC3CC3C2)CCCC1
InChIInChI=1S/C12H22N2/c1-13-12(4-2-3-5-12)9-14-7-10-6-11(10)8-14/h10-11,13H,2-9H2,1H3
InChIKeyBGIMONQITGONTL-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.47
Rot. Bonds3

About 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine

1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine (PubChem CID 130848515) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine
PubChem CID130848515
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine
SMILESCNC1(CN2CC3CC3C2)CCCC1
InChIInChI=1S/C12H22N2/c1-13-12(4-2-3-5-12)9-14-7-10-6-11(10)8-14/h10-11,13H,2-9H2,1H3
InChIKeyBGIMONQITGONTL-UHFFFAOYSA-N
XLogP1.47
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine?
The IUPAC name of 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine (CID 130848515) is 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine.
What is the SMILES notation for 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine?
The canonical SMILES for 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine is CNC1(CN2CC3CC3C2)CCCC1.
What is the InChIKey of 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine?
The InChIKey is BGIMONQITGONTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-13-12(4-2-3-5-12)9-14-7-10-6-11(10)8-14/h10-11,13H,2-9H2,1H3.
What are the key properties of 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine?
1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine has a molecular weight of 194.32 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-azabicyclo[3.1.0]hexan-3-ylmethyl)-N-methylcyclopentan-1-amine is sourced from PubChem (CID 130848515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).