N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine

C10H22N2O2 — CID 63698136

IUPACN'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine
SMILESCOC(CNCCN(C)C1CC1)OC
InChIInChI=1S/C10H22N2O2/c1-12(9-4-5-9)7-6-11-8-10(13-2)14-3/h9-11H,4-8H2,1-3H3
InChIKeyGLPVSJJWIKRJHV-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.29
Rot. Bonds8

About N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine

N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine (PubChem CID 63698136) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine
PubChem CID63698136
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC NameN'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine
SMILESCOC(CNCCN(C)C1CC1)OC
InChIInChI=1S/C10H22N2O2/c1-12(9-4-5-9)7-6-11-8-10(13-2)14-3/h9-11H,4-8H2,1-3H3
InChIKeyGLPVSJJWIKRJHV-UHFFFAOYSA-N
XLogP0.29
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine (CID 63698136) is N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine is COC(CNCCN(C)C1CC1)OC.
What is the InChIKey of N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine?
The InChIKey is GLPVSJJWIKRJHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-12(9-4-5-9)7-6-11-8-10(13-2)14-3/h9-11H,4-8H2,1-3H3.
What are the key properties of N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine?
N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine has a molecular weight of 202.30 g/mol, XLogP of 0.29, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N-(2,2-dimethoxyethyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 63698136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).