1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine

C13H25NO — CID 62632079

IUPAC1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine
SMILESCC(NC(C)C1CCCO1)C1CCCC1
InChIInChI=1S/C13H25NO/c1-10(12-6-3-4-7-12)14-11(2)13-8-5-9-15-13/h10-14H,3-9H2,1-2H3
InChIKeyHQJVYWXAYRXLJB-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.72
Rot. Bonds4

About 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine

1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine (PubChem CID 62632079) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine.

Molecular Properties

Compound Name1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine
PubChem CID62632079
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine
SMILESCC(NC(C)C1CCCO1)C1CCCC1
InChIInChI=1S/C13H25NO/c1-10(12-6-3-4-7-12)14-11(2)13-8-5-9-15-13/h10-14H,3-9H2,1-2H3
InChIKeyHQJVYWXAYRXLJB-UHFFFAOYSA-N
XLogP2.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine?
The IUPAC name of 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine (CID 62632079) is 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine.
What is the SMILES notation for 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine?
The canonical SMILES for 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine is CC(NC(C)C1CCCO1)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine?
The InChIKey is HQJVYWXAYRXLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-10(12-6-3-4-7-12)14-11(2)13-8-5-9-15-13/h10-14H,3-9H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine?
1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine has a molecular weight of 211.35 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[1-(oxolan-2-yl)ethyl]ethanamine is sourced from PubChem (CID 62632079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).