1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine

C13H25NO2 — CID 104610994

IUPAC1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine
SMILESCNC(C1CCOCC1)C1(OC)CCCC1
InChIInChI=1S/C13H25NO2/c1-14-12(11-5-9-16-10-6-11)13(15-2)7-3-4-8-13/h11-12,14H,3-10H2,1-2H3
InChIKeyXORKXNQAUWRAPP-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.96
Rot. Bonds4

About 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine

1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine (PubChem CID 104610994) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine.

Molecular Properties

Compound Name1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine
PubChem CID104610994
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine
SMILESCNC(C1CCOCC1)C1(OC)CCCC1
InChIInChI=1S/C13H25NO2/c1-14-12(11-5-9-16-10-6-11)13(15-2)7-3-4-8-13/h11-12,14H,3-10H2,1-2H3
InChIKeyXORKXNQAUWRAPP-UHFFFAOYSA-N
XLogP1.96
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-ethylcyclohexyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770174
1-(3,4-dimethylcyclohexyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770194
(1-methoxycyclobutyl)-(oxan-4-yl)methanol
CID 116710425
1-(1-ethoxy-4-methylcyclohexyl)-N-methyl-1-(oxan-4-yl)methanamine
CID 116767242
1-cyclobutyl-1-(4-ethoxyoxan-4-yl)-N-methylmethanamine
CID 116765744
[cyclopropyl-(1-methoxycycloheptyl)methyl]hydrazine
CID 105278128
1-(1-methoxycyclopentyl)-N-methyl-1-(3-methylsulfonylcyclohexyl)methanamine
CID 104610833
1-[1-(aminomethyl)cyclopropyl]-N-methyl-1-(oxan-4-yl)methanamine
CID 116958494
N-methyl-1-(oxan-4-yl)-1-(1-phenylcyclohexyl)methanamine
CID 63935895
1-(1-ethoxy-4,4-dimethylcyclohexyl)-N-methyl-1-(oxolan-3-yl)methanamine
CID 116768763
(4-methoxyoxan-4-yl)-(oxan-4-yl)methanol
CID 116753889
2-cyclobutyl-1-(4-methoxyoxan-4-yl)-N-methylethanamine
CID 116764713

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine?
The IUPAC name of 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine (CID 104610994) is 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine.
What is the SMILES notation for 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine?
The canonical SMILES for 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine is CNC(C1CCOCC1)C1(OC)CCCC1.
What is the InChIKey of 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine?
The InChIKey is XORKXNQAUWRAPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-14-12(11-5-9-16-10-6-11)13(15-2)7-3-4-8-13/h11-12,14H,3-10H2,1-2H3.
What are the key properties of 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine?
1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine has a molecular weight of 227.35 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxycyclopentyl)-N-methyl-1-(oxan-4-yl)methanamine is sourced from PubChem (CID 104610994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).