N,9-dimethylspiro[5.5]undecan-3-amine

C13H25N — CID 164846415

IUPACN,9-dimethylspiro[5.5]undecan-3-amine
SMILESCNC1CCC2(CCC(C)CC2)CC1
InChIInChI=1S/C13H25N/c1-11-3-7-13(8-4-11)9-5-12(14-2)6-10-13/h11-12,14H,3-10H2,1-2H3
InChIKeyFXHCWKYIXPRZNY-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds1

About N,9-dimethylspiro[5.5]undecan-3-amine

N,9-dimethylspiro[5.5]undecan-3-amine (PubChem CID 164846415) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N,9-dimethylspiro[5.5]undecan-3-amine.

Molecular Properties

Compound NameN,9-dimethylspiro[5.5]undecan-3-amine
PubChem CID164846415
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN,9-dimethylspiro[5.5]undecan-3-amine
SMILESCNC1CCC2(CCC(C)CC2)CC1
InChIInChI=1S/C13H25N/c1-11-3-7-13(8-4-11)9-5-12(14-2)6-10-13/h11-12,14H,3-10H2,1-2H3
InChIKeyFXHCWKYIXPRZNY-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,8-dimethylspiro[4.5]decan-3-amine
CID 164846336
3,9-dimethylspiro[5.5]undecane
CID 20825106
3,9-dimethylspiro[5.5]undecane;methanamine
CID 176558454
ethane;6-methylspiro[2.5]octane
CID 142110397
3-methylspiro[5.6]dodecane
CID 143797283
N,4-dimethylcyclohexan-1-amine;hydrochloride
CID 18472520
3,11-dimethyldispiro[5.1.58.16]tetradecane
CID 18633626
(3R,8R)-3,8-dimethylspiro[4.4]nonane
CID 171400850
2,7-dimethylspiro[3.4]octane
CID 142902956
3,8-dimethylspiro[4.4]nonane;ethane
CID 178108265
N-(3-methylcyclopentyl)spiro[4.5]decan-8-amine
CID 114817955
1-(9-methylspiro[5.5]undecan-3-yl)azetidine
CID 90712443

Frequently Asked Questions

What is the IUPAC name of N,9-dimethylspiro[5.5]undecan-3-amine?
The IUPAC name of N,9-dimethylspiro[5.5]undecan-3-amine (CID 164846415) is N,9-dimethylspiro[5.5]undecan-3-amine.
What is the SMILES notation for N,9-dimethylspiro[5.5]undecan-3-amine?
The canonical SMILES for N,9-dimethylspiro[5.5]undecan-3-amine is CNC1CCC2(CCC(C)CC2)CC1.
What is the InChIKey of N,9-dimethylspiro[5.5]undecan-3-amine?
The InChIKey is FXHCWKYIXPRZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-11-3-7-13(8-4-11)9-5-12(14-2)6-10-13/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N,9-dimethylspiro[5.5]undecan-3-amine?
N,9-dimethylspiro[5.5]undecan-3-amine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,9-dimethylspiro[5.5]undecan-3-amine is sourced from PubChem (CID 164846415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).