4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine

C13H27NO2 — CID 103036040

IUPAC4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine
SMILESCOC(C)(C)CCC(N)C1(OC)CCCC1
InChIInChI=1S/C13H27NO2/c1-12(2,15-3)10-7-11(14)13(16-4)8-5-6-9-13/h11H,5-10,14H2,1-4H3
InChIKeyUKEKQNLVTINTJC-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.48
Rot. Bonds6

About 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine

4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine (PubChem CID 103036040) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine.

Molecular Properties

Compound Name4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine
PubChem CID103036040
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine
SMILESCOC(C)(C)CCC(N)C1(OC)CCCC1
InChIInChI=1S/C13H27NO2/c1-12(2,15-3)10-7-11(14)13(16-4)8-5-6-9-13/h11H,5-10,14H2,1-4H3
InChIKeyUKEKQNLVTINTJC-UHFFFAOYSA-N
XLogP2.48
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-Methoxy-1-(1-methoxycyclopentyl)-4-methylpentyl]hydrazine
CID 103027058
(3,7-Dimethoxy-3,7-dimethyloctan-4-yl)hydrazine
CID 103027102
(3-Ethyl-3,7-dimethoxy-7-methyloctan-4-yl)hydrazine
CID 103027111
3-Methoxy-3-methyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-amine
CID 103029491
1,5-Dimethoxy-5-methylhexan-2-amine
CID 103031141
2,6-Dimethoxy-6-methylheptan-3-amine
CID 103031621
4-Methoxy-4-methyl-1-(3-methyloxolan-2-yl)pentan-1-amine
CID 103031623
1-(1-Ethylcyclopentyl)-4-methoxy-4-methylpentan-1-amine
CID 103032100
4-Methoxy-4-methyl-1-(5-methyloxolan-2-yl)pentan-1-amine
CID 103032101
4-Methoxy-4-methyl-1-(oxan-2-yl)pentan-1-amine
CID 103032271
4-Methoxy-4-methyl-1-(oxolan-2-yl)pentan-1-amine
CID 103032335
4-Methoxy-4-methyl-1-(3-methylcyclopentyl)pentan-1-amine
CID 103035737

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine?
The IUPAC name of 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine (CID 103036040) is 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine.
What is the SMILES notation for 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine?
The canonical SMILES for 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine is COC(C)(C)CCC(N)C1(OC)CCCC1.
What is the InChIKey of 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine?
The InChIKey is UKEKQNLVTINTJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-12(2,15-3)10-7-11(14)13(16-4)8-5-6-9-13/h11H,5-10,14H2,1-4H3.
What are the key properties of 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine?
4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine has a molecular weight of 229.36 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(1-methoxycyclopentyl)-4-methylpentan-1-amine is sourced from PubChem (CID 103036040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).