1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol

C14H28N2O2 — CID 79586937

IUPAC1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol
SMILESCCC1COCCN1CCC1CCCC1(O)CN
InChIInChI=1S/C14H28N2O2/c1-2-13-10-18-9-8-16(13)7-5-12-4-3-6-14(12,17)11-15/h12-13,17H,2-11,15H2,1H3
InChIKeyRQLUGYWSVHDORG-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.98
Rot. Bonds5

About 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol

1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol (PubChem CID 79586937) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol
PubChem CID79586937
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol
SMILESCCC1COCCN1CCC1CCCC1(O)CN
InChIInChI=1S/C14H28N2O2/c1-2-13-10-18-9-8-16(13)7-5-12-4-3-6-14(12,17)11-15/h12-13,17H,2-11,15H2,1H3
InChIKeyRQLUGYWSVHDORG-UHFFFAOYSA-N
XLogP0.98
TPSA58.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol?
The IUPAC name of 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol (CID 79586937) is 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol?
The canonical SMILES for 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol is CCC1COCCN1CCC1CCCC1(O)CN.
What is the InChIKey of 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol?
The InChIKey is RQLUGYWSVHDORG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-2-13-10-18-9-8-16(13)7-5-12-4-3-6-14(12,17)11-15/h12-13,17H,2-11,15H2,1H3.
What are the key properties of 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol?
1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol has a molecular weight of 256.39 g/mol, XLogP of 0.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-2-[2-(3-ethylmorpholin-4-yl)ethyl]cyclopentan-1-ol is sourced from PubChem (CID 79586937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).