(5,5-dimethylcyclononyl)methanamine

C12H25N — CID 129138997

IUPAC(5,5-dimethylcyclononyl)methanamine
SMILESCC1(C)CCCCC(CN)CCC1
InChIInChI=1S/C12H25N/c1-12(2)8-4-3-6-11(10-13)7-5-9-12/h11H,3-10,13H2,1-2H3
InChIKeyNYNCNEIGXSTGPA-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.33
Rot. Bonds1

About (5,5-dimethylcyclononyl)methanamine

(5,5-dimethylcyclononyl)methanamine (PubChem CID 129138997) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is (5,5-dimethylcyclononyl)methanamine.

Molecular Properties

Compound Name(5,5-dimethylcyclononyl)methanamine
PubChem CID129138997
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name(5,5-dimethylcyclononyl)methanamine
SMILESCC1(C)CCCCC(CN)CCC1
InChIInChI=1S/C12H25N/c1-12(2)8-4-3-6-11(10-13)7-5-9-12/h11H,3-10,13H2,1-2H3
InChIKeyNYNCNEIGXSTGPA-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

cyclohexylmethanamine;methanol
CID 70430105
cyclohexylmethanamine;hydrochloride
CID 3039618
cyclohexylmethanamine;hydrobromide
CID 13001131
3-(aminomethyl)-1-methylcyclohexan-1-amine
CID 11804870
carbonyl dichloride;cyclopentylmethanamine
CID 175500513
(5-methylcyclononyl)methanamine
CID 91548607
cyclohexanamine;cyclohexylmethanamine
CID 174974863
[4-(aminomethyl)-4-methylcyclohexyl]methanamine
CID 123492077
5,5-dimethylcyclononan-1-ol
CID 130122952
1,1,5-trimethylcycloundecane
CID 161434950
1,1-dimethyl-4-propylcyclotridecane
CID 123608299
[(1S)-2,2-dimethylcyclohexyl]methanamine
CID 90019536

Frequently Asked Questions

What is the IUPAC name of (5,5-dimethylcyclononyl)methanamine?
The IUPAC name of (5,5-dimethylcyclononyl)methanamine (CID 129138997) is (5,5-dimethylcyclononyl)methanamine.
What is the SMILES notation for (5,5-dimethylcyclononyl)methanamine?
The canonical SMILES for (5,5-dimethylcyclononyl)methanamine is CC1(C)CCCCC(CN)CCC1.
What is the InChIKey of (5,5-dimethylcyclononyl)methanamine?
The InChIKey is NYNCNEIGXSTGPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-12(2)8-4-3-6-11(10-13)7-5-9-12/h11H,3-10,13H2,1-2H3.
What are the key properties of (5,5-dimethylcyclononyl)methanamine?
(5,5-dimethylcyclononyl)methanamine has a molecular weight of 183.34 g/mol, XLogP of 3.33, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5,5-dimethylcyclononyl)methanamine is sourced from PubChem (CID 129138997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).