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

C9H20N2O — CID 61451774

IUPACN'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine
SMILESCNCCN(CCOC)C1CC1
InChIInChI=1S/C9H20N2O/c1-10-5-6-11(7-8-12-2)9-3-4-9/h9-10H,3-8H2,1-2H3
InChIKeyJMKBAWHCRFHKSD-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.32
Rot. Bonds7

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

N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine (PubChem CID 61451774) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine
PubChem CID61451774
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC NameN'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine
SMILESCNCCN(CCOC)C1CC1
InChIInChI=1S/C9H20N2O/c1-10-5-6-11(7-8-12-2)9-3-4-9/h9-10H,3-8H2,1-2H3
InChIKeyJMKBAWHCRFHKSD-UHFFFAOYSA-N
XLogP0.32
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine?
The IUPAC name of N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine (CID 61451774) is N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine?
The canonical SMILES for N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine is CNCCN(CCOC)C1CC1.
What is the InChIKey of N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine?
The InChIKey is JMKBAWHCRFHKSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-10-5-6-11(7-8-12-2)9-3-4-9/h9-10H,3-8H2,1-2H3.
What are the key properties of N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine?
N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine has a molecular weight of 172.27 g/mol, XLogP of 0.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopropyl-N'-(2-methoxyethyl)-N-methylethane-1,2-diamine is sourced from PubChem (CID 61451774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).