1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine

C12H24N2O — CID 61433666

IUPAC1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
SMILESCCN(CC1CCCO1)C(CN)C1CC1
InChIInChI=1S/C12H24N2O/c1-2-14(9-11-4-3-7-15-11)12(8-13)10-5-6-10/h10-12H,2-9,13H2,1H3
InChIKeyIQLCVZHRUKJUST-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.22
Rot. Bonds6

About 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine

1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine (PubChem CID 61433666) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
PubChem CID61433666
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine
SMILESCCN(CC1CCCO1)C(CN)C1CC1
InChIInChI=1S/C12H24N2O/c1-2-14(9-11-4-3-7-15-11)12(8-13)10-5-6-10/h10-12H,2-9,13H2,1H3
InChIKeyIQLCVZHRUKJUST-UHFFFAOYSA-N
XLogP1.22
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine?
The IUPAC name of 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine (CID 61433666) is 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine is CCN(CC1CCCO1)C(CN)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine?
The InChIKey is IQLCVZHRUKJUST-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-2-14(9-11-4-3-7-15-11)12(8-13)10-5-6-10/h10-12H,2-9,13H2,1H3.
What are the key properties of 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine?
1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine has a molecular weight of 212.34 g/mol, XLogP of 1.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-N-(oxolan-2-ylmethyl)ethane-1,2-diamine is sourced from PubChem (CID 61433666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).