1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane

C17H37N — CID 173093109

IUPAC1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane
SMILESC.C.CNCC1CCCCCC(C2CCCC2)C1
InChIInChI=1S/C15H29N.2CH4/c1-16-12-13-7-3-2-4-10-15(11-13)14-8-5-6-9-14;;/h13-16H,2-12H2,1H3;2*1H4
InChIKeyRPKMPMCTHYYQSG-UHFFFAOYSA-N
MW255.49 g/mol
LogP5.25
Rot. Bonds3

About 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane

1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane (PubChem CID 173093109) has the molecular formula C17H37N and a molecular weight of 255.49 g/mol. Its IUPAC name is 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane.

Molecular Properties

Compound Name1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane
PubChem CID173093109
Molecular FormulaC17H37N
Molecular Weight255.49 g/mol
Exact Mass255.29
IUPAC Name1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane
SMILESC.C.CNCC1CCCCCC(C2CCCC2)C1
InChIInChI=1S/C15H29N.2CH4/c1-16-12-13-7-3-2-4-10-15(11-13)14-8-5-6-9-14;;/h13-16H,2-12H2,1H3;2*1H4
InChIKeyRPKMPMCTHYYQSG-UHFFFAOYSA-N
XLogP5.25
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500255.49
LogP ≤ 55.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclopentyl-N-methylmethanamine;molecular hydrogen
CID 142969533
1-(5-cyclononyloxolan-3-yl)-N-methylmethanamine
CID 134220033
N-methyl-1-[(5R)-5-methylcyclononyl]methanamine
CID 155332043
3-(2-cycloheptylethyl)-2,3,4,4a,5,6,7,8,9,10,11,11a-dodecahydro-1H-benzo[9]annulene
CID 90780974
(3-ethylcyclopentyl)cyclohexane
CID 142208206
ethane;methanamine;[3-(methylaminomethyl)cyclohexyl]methanamine
CID 142040832
1-[3-[(dimethylamino)methyl]cyclohexyl]-N-methylmethanamine
CID 19029842
7-ethyl-3-(3-ethylcyclohexyl)bicyclo[9.4.0]pentadecane
CID 58552621
1-(2-cyclohexylcyclobutyl)-N-methylmethanamine
CID 81017372
1-(2-cyclohexylcycloheptyl)-N-methylmethanamine
CID 81025955
(2S)-2-N-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-ylmethyl)propane-1,2-diamine
CID 104867674
1-[2-(cyclohexylmethyl)cyclopentyl]-N-methylmethanamine
CID 81033803

Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane?
The IUPAC name of 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane (CID 173093109) is 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane.
What is the SMILES notation for 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane?
The canonical SMILES for 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane is C.C.CNCC1CCCCCC(C2CCCC2)C1.
What is the InChIKey of 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane?
The InChIKey is RPKMPMCTHYYQSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N.2CH4/c1-16-12-13-7-3-2-4-10-15(11-13)14-8-5-6-9-14;;/h13-16H,2-12H2,1H3;2*1H4.
What are the key properties of 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane?
1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane has a molecular weight of 255.49 g/mol, XLogP of 5.25, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentylcyclooctyl)-N-methylmethanamine;methane is sourced from PubChem (CID 173093109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).