3-N-cyclopentyloxane-3,4-diamine

C10H20N2O — CID 67358051

IUPAC3-N-cyclopentyloxane-3,4-diamine
SMILESNC1CCOCC1NC1CCCC1
InChIInChI=1S/C10H20N2O/c11-9-5-6-13-7-10(9)12-8-3-1-2-4-8/h8-10,12H,1-7,11H2
InChIKeyVLIALUDTQGCTQH-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.63
Rot. Bonds2

About 3-N-cyclopentyloxane-3,4-diamine

3-N-cyclopentyloxane-3,4-diamine (PubChem CID 67358051) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-N-cyclopentyloxane-3,4-diamine.

Molecular Properties

Compound Name3-N-cyclopentyloxane-3,4-diamine
PubChem CID67358051
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-N-cyclopentyloxane-3,4-diamine
SMILESNC1CCOCC1NC1CCCC1
InChIInChI=1S/C10H20N2O/c11-9-5-6-13-7-10(9)12-8-3-1-2-4-8/h8-10,12H,1-7,11H2
InChIKeyVLIALUDTQGCTQH-UHFFFAOYSA-N
XLogP0.63
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-N-cyclopentyloxane-3,4-diamine?
The IUPAC name of 3-N-cyclopentyloxane-3,4-diamine (CID 67358051) is 3-N-cyclopentyloxane-3,4-diamine.
What is the SMILES notation for 3-N-cyclopentyloxane-3,4-diamine?
The canonical SMILES for 3-N-cyclopentyloxane-3,4-diamine is NC1CCOCC1NC1CCCC1.
What is the InChIKey of 3-N-cyclopentyloxane-3,4-diamine?
The InChIKey is VLIALUDTQGCTQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c11-9-5-6-13-7-10(9)12-8-3-1-2-4-8/h8-10,12H,1-7,11H2.
What are the key properties of 3-N-cyclopentyloxane-3,4-diamine?
3-N-cyclopentyloxane-3,4-diamine has a molecular weight of 184.28 g/mol, XLogP of 0.63, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclopentyloxane-3,4-diamine is sourced from PubChem (CID 67358051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).