[1-(cyclopentylmethoxy)cycloheptyl]methanamine

C14H27NO — CID 65051749

IUPAC[1-(cyclopentylmethoxy)cycloheptyl]methanamine
SMILESNCC1(OCC2CCCC2)CCCCCC1
InChIInChI=1S/C14H27NO/c15-12-14(9-5-1-2-6-10-14)16-11-13-7-3-4-8-13/h13H,1-12,15H2
InChIKeyPBFXHTLDFLOJLW-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.24
Rot. Bonds4

About [1-(cyclopentylmethoxy)cycloheptyl]methanamine

[1-(cyclopentylmethoxy)cycloheptyl]methanamine (PubChem CID 65051749) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is [1-(cyclopentylmethoxy)cycloheptyl]methanamine.

Molecular Properties

Compound Name[1-(cyclopentylmethoxy)cycloheptyl]methanamine
PubChem CID65051749
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name[1-(cyclopentylmethoxy)cycloheptyl]methanamine
SMILESNCC1(OCC2CCCC2)CCCCCC1
InChIInChI=1S/C14H27NO/c15-12-14(9-5-1-2-6-10-14)16-11-13-7-3-4-8-13/h13H,1-12,15H2
InChIKeyPBFXHTLDFLOJLW-UHFFFAOYSA-N
XLogP3.24
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(cyclohexylmethoxy)cyclohexyl]methanamine
CID 62383521
2-[1-(cyclohexylmethoxy)cyclobutyl]ethanamine
CID 103273986
[1-(oxolan-3-ylmethoxy)cyclohexyl]methanamine
CID 62109560
1-[1-(cycloheptylmethoxy)cyclohexyl]-N-methylmethanamine
CID 114248811
1-[1-(cyclopentylmethoxy)cycloheptyl]-N-methylmethanamine
CID 66322900
[4-(cyclopropylmethoxy)oxan-4-yl]methanamine
CID 65051703
[1-(cyclobutylmethoxy)-3-methylcyclopentyl]methanamine
CID 65458688
[1-[(5-methyloxolan-2-yl)methoxy]cycloheptyl]methanamine
CID 103132528
[4,4-dimethyl-1-(oxan-4-ylmethoxy)cyclohexyl]methanamine
CID 65052287
[1-(3-ethoxypropoxy)cycloheptyl]methanamine
CID 65176333
4-[[1-(bromomethyl)cyclohexyl]oxymethyl]oxane
CID 62382188
(1-ethoxy-4-ethylcycloheptyl)methanamine
CID 66073194

Frequently Asked Questions

What is the IUPAC name of [1-(cyclopentylmethoxy)cycloheptyl]methanamine?
The IUPAC name of [1-(cyclopentylmethoxy)cycloheptyl]methanamine (CID 65051749) is [1-(cyclopentylmethoxy)cycloheptyl]methanamine.
What is the SMILES notation for [1-(cyclopentylmethoxy)cycloheptyl]methanamine?
The canonical SMILES for [1-(cyclopentylmethoxy)cycloheptyl]methanamine is NCC1(OCC2CCCC2)CCCCCC1.
What is the InChIKey of [1-(cyclopentylmethoxy)cycloheptyl]methanamine?
The InChIKey is PBFXHTLDFLOJLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c15-12-14(9-5-1-2-6-10-14)16-11-13-7-3-4-8-13/h13H,1-12,15H2.
What are the key properties of [1-(cyclopentylmethoxy)cycloheptyl]methanamine?
[1-(cyclopentylmethoxy)cycloheptyl]methanamine has a molecular weight of 225.38 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclopentylmethoxy)cycloheptyl]methanamine is sourced from PubChem (CID 65051749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).