1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine

C13H25N — CID 115846091

IUPAC1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine
SMILESCCC(C)CC(NC)C1C2CCCC21
InChIInChI=1S/C13H25N/c1-4-9(2)8-12(14-3)13-10-6-5-7-11(10)13/h9-14H,4-8H2,1-3H3
InChIKeyDVXUEUHXRTVBHI-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.06
Rot. Bonds5

About 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine

1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine (PubChem CID 115846091) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine.

Molecular Properties

Compound Name1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine
PubChem CID115846091
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine
SMILESCCC(C)CC(NC)C1C2CCCC21
InChIInChI=1S/C13H25N/c1-4-9(2)8-12(14-3)13-10-6-5-7-11(10)13/h9-14H,4-8H2,1-3H3
InChIKeyDVXUEUHXRTVBHI-UHFFFAOYSA-N
XLogP3.06
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(6-bicyclo[3.1.0]hexanyl)-3-methylpentan-1-ol
CID 115789262
1-(4,4-dimethylcyclohexyl)-N,3-dimethylpentan-1-amine
CID 65391816
1-cycloheptyl-N-ethyl-3-methylpentan-1-amine
CID 65399965
1-(7-bicyclo[4.1.0]heptanyl)-2-ethoxy-N-methylethanamine
CID 105007901
1-(7-bicyclo[4.1.0]heptanyl)-N,3-diethylpentan-1-amine
CID 105027980
1-cyclopentyl-N,5-dimethylheptan-3-amine
CID 115846256
1-cyclohexylsulfanyl-N,4-dimethylhexan-2-amine
CID 65139959
1-(7-bicyclo[4.1.0]heptanyl)-4-methoxy-N-methylbutan-1-amine
CID 105054829
N-(4-methylhexan-2-yl)cyclopropanamine
CID 103439280
1-cyclobutyl-N,3-dimethylbutan-1-amine
CID 64986919
1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-2-(2,4,6-trimethylphenyl)ethanamine
CID 115828599
trans-(1R,2R)-2-(4-methylhexan-2-ylamino)cyclohexan-1-ol
CID 102731345

Frequently Asked Questions

What is the IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine?
The IUPAC name of 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine (CID 115846091) is 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine.
What is the SMILES notation for 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine?
The canonical SMILES for 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine is CCC(C)CC(NC)C1C2CCCC21.
What is the InChIKey of 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine?
The InChIKey is DVXUEUHXRTVBHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-4-9(2)8-12(14-3)13-10-6-5-7-11(10)13/h9-14H,4-8H2,1-3H3.
What are the key properties of 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine?
1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bicyclo[3.1.0]hexanyl)-N,3-dimethylpentan-1-amine is sourced from PubChem (CID 115846091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).