N-methyl-1-spiro[5.5]undecan-3-ylmethanamine

C13H25N — CID 83907913

IUPACN-methyl-1-spiro[5.5]undecan-3-ylmethanamine
SMILESCNCC1CCC2(CCCCC2)CC1
InChIInChI=1S/C13H25N/c1-14-11-12-5-9-13(10-6-12)7-3-2-4-8-13/h12,14H,2-11H2,1H3
InChIKeyMINVNRGTGVXRJK-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.35
Rot. Bonds2

About N-methyl-1-spiro[5.5]undecan-3-ylmethanamine

N-methyl-1-spiro[5.5]undecan-3-ylmethanamine (PubChem CID 83907913) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-methyl-1-spiro[5.5]undecan-3-ylmethanamine.

Molecular Properties

Compound NameN-methyl-1-spiro[5.5]undecan-3-ylmethanamine
PubChem CID83907913
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-methyl-1-spiro[5.5]undecan-3-ylmethanamine
SMILESCNCC1CCC2(CCCCC2)CC1
InChIInChI=1S/C13H25N/c1-14-11-12-5-9-13(10-6-12)7-3-2-4-8-13/h12,14H,2-11H2,1H3
InChIKeyMINVNRGTGVXRJK-UHFFFAOYSA-N
XLogP3.35
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-1-spiro[3.4]octan-7-ylmethanamine
CID 170362229
1-[1-(3-azaspiro[5.5]undecan-3-ylsulfonyl)piperidin-4-yl]-N-methylmethanamine
CID 119978145
spiro[5.5]undecan-3-ylmethylazanium
CID 58073628
3-(2,2-dimethylpropyl)spiro[5.5]undecane
CID 140695301
3-propylspiro[5.6]dodecane
CID 163613469
methyl 2-spiro[5.5]undecan-3-ylacetate
CID 118404685
1-cyclopentyl-N-methylmethanamine;molecular hydrogen
CID 142969533
N-methyl-1-(1-spiro[4.5]decan-8-ylpyrrolidin-2-yl)methanamine
CID 114818954
N-methyl-1-[(7R)-7-methylspiro[3.4]octan-2-yl]methanamine
CID 155332094
spiro[5.6]dodecan-3-amine
CID 56639662
3-methylspiro[5.6]dodecane
CID 143797283
1-(2,2-dimethylcycloheptyl)-N-methylmethanamine
CID 83905807

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-spiro[5.5]undecan-3-ylmethanamine?
The IUPAC name of N-methyl-1-spiro[5.5]undecan-3-ylmethanamine (CID 83907913) is N-methyl-1-spiro[5.5]undecan-3-ylmethanamine.
What is the SMILES notation for N-methyl-1-spiro[5.5]undecan-3-ylmethanamine?
The canonical SMILES for N-methyl-1-spiro[5.5]undecan-3-ylmethanamine is CNCC1CCC2(CCCCC2)CC1.
What is the InChIKey of N-methyl-1-spiro[5.5]undecan-3-ylmethanamine?
The InChIKey is MINVNRGTGVXRJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-14-11-12-5-9-13(10-6-12)7-3-2-4-8-13/h12,14H,2-11H2,1H3.
What are the key properties of N-methyl-1-spiro[5.5]undecan-3-ylmethanamine?
N-methyl-1-spiro[5.5]undecan-3-ylmethanamine has a molecular weight of 195.35 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-spiro[5.5]undecan-3-ylmethanamine is sourced from PubChem (CID 83907913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).