1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine

C11H22N2O — CID 65376736

IUPAC1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
SMILESNCC1(NCC2CCCO2)CCCC1
InChIInChI=1S/C11H22N2O/c12-9-11(5-1-2-6-11)13-8-10-4-3-7-14-10/h10,13H,1-9,12H2
InChIKeyZCDZVRSPGUANAZ-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.03
Rot. Bonds4

About 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine

1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine (PubChem CID 65376736) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
PubChem CID65376736
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine
SMILESNCC1(NCC2CCCO2)CCCC1
InChIInChI=1S/C11H22N2O/c12-9-11(5-1-2-6-11)13-8-10-4-3-7-14-10/h10,13H,1-9,12H2
InChIKeyZCDZVRSPGUANAZ-UHFFFAOYSA-N
XLogP1.03
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine (CID 65376736) is 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine is NCC1(NCC2CCCO2)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
The InChIKey is ZCDZVRSPGUANAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c12-9-11(5-1-2-6-11)13-8-10-4-3-7-14-10/h10,13H,1-9,12H2.
What are the key properties of 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine?
1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine has a molecular weight of 198.31 g/mol, XLogP of 1.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-(oxolan-2-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 65376736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).