1-cyclopropyl-N-ethylethane-1,2-diamine

C7H16N2 — CID 62066227

IUPAC1-cyclopropyl-N-ethylethane-1,2-diamine
SMILESCCNC(CN)C1CC1
InChIInChI=1S/C7H16N2/c1-2-9-7(5-8)6-3-4-6/h6-7,9H,2-5,8H2,1H3
InChIKeyJZILDWLXYXLNKZ-UHFFFAOYSA-N
MW128.22 g/mol
LogP0.33
Rot. Bonds4

About 1-cyclopropyl-N-ethylethane-1,2-diamine

1-cyclopropyl-N-ethylethane-1,2-diamine (PubChem CID 62066227) has the molecular formula C7H16N2 and a molecular weight of 128.22 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethylethane-1,2-diamine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethylethane-1,2-diamine
PubChem CID62066227
Molecular FormulaC7H16N2
Molecular Weight128.22 g/mol
Exact Mass128.13
IUPAC Name1-cyclopropyl-N-ethylethane-1,2-diamine
SMILESCCNC(CN)C1CC1
InChIInChI=1S/C7H16N2/c1-2-9-7(5-8)6-3-4-6/h6-7,9H,2-5,8H2,1H3
InChIKeyJZILDWLXYXLNKZ-UHFFFAOYSA-N
XLogP0.33
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethylethane-1,2-diamine?
The IUPAC name of 1-cyclopropyl-N-ethylethane-1,2-diamine (CID 62066227) is 1-cyclopropyl-N-ethylethane-1,2-diamine.
What is the SMILES notation for 1-cyclopropyl-N-ethylethane-1,2-diamine?
The canonical SMILES for 1-cyclopropyl-N-ethylethane-1,2-diamine is CCNC(CN)C1CC1.
What is the InChIKey of 1-cyclopropyl-N-ethylethane-1,2-diamine?
The InChIKey is JZILDWLXYXLNKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2/c1-2-9-7(5-8)6-3-4-6/h6-7,9H,2-5,8H2,1H3.
What are the key properties of 1-cyclopropyl-N-ethylethane-1,2-diamine?
1-cyclopropyl-N-ethylethane-1,2-diamine has a molecular weight of 128.22 g/mol, XLogP of 0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethylethane-1,2-diamine is sourced from PubChem (CID 62066227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).