1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine

C10H22N2O — CID 62540617

IUPAC1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine
SMILESCOCCNC(CN)C1CCCC1
InChIInChI=1S/C10H22N2O/c1-13-7-6-12-10(8-11)9-4-2-3-5-9/h9-10,12H,2-8,11H2,1H3
InChIKeyKCPFVLNTPXPZKW-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.74
Rot. Bonds6

About 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine

1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine (PubChem CID 62540617) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine
PubChem CID62540617
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine
SMILESCOCCNC(CN)C1CCCC1
InChIInChI=1S/C10H22N2O/c1-13-7-6-12-10(8-11)9-4-2-3-5-9/h9-10,12H,2-8,11H2,1H3
InChIKeyKCPFVLNTPXPZKW-UHFFFAOYSA-N
XLogP0.74
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine?
The IUPAC name of 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine (CID 62540617) is 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine.
What is the SMILES notation for 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine?
The canonical SMILES for 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine is COCCNC(CN)C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine?
The InChIKey is KCPFVLNTPXPZKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-13-7-6-12-10(8-11)9-4-2-3-5-9/h9-10,12H,2-8,11H2,1H3.
What are the key properties of 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine?
1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine has a molecular weight of 186.30 g/mol, XLogP of 0.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-(2-methoxyethyl)ethane-1,2-diamine is sourced from PubChem (CID 62540617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).