1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine

C10H22N2O — CID 175624615

IUPAC1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine
SMILESC=C(C)N(CCOC)C(C)N(C)C
InChIInChI=1S/C10H22N2O/c1-9(2)12(7-8-13-6)10(3)11(4)5/h10H,1,7-8H2,2-6H3
InChIKeyVSCMTMKOIHHWTG-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.38
Rot. Bonds6

About 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine

1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine (PubChem CID 175624615) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine.

Molecular Properties

Compound Name1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine
PubChem CID175624615
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine
SMILESC=C(C)N(CCOC)C(C)N(C)C
InChIInChI=1S/C10H22N2O/c1-9(2)12(7-8-13-6)10(3)11(4)5/h10H,1,7-8H2,2-6H3
InChIKeyVSCMTMKOIHHWTG-UHFFFAOYSA-N
XLogP1.38
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine?
The IUPAC name of 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine (CID 175624615) is 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine.
What is the SMILES notation for 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine?
The canonical SMILES for 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine is C=C(C)N(CCOC)C(C)N(C)C.
What is the InChIKey of 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine?
The InChIKey is VSCMTMKOIHHWTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(2)12(7-8-13-6)10(3)11(4)5/h10H,1,7-8H2,2-6H3.
What are the key properties of 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine?
1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine has a molecular weight of 186.30 g/mol, XLogP of 1.38, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N'-(2-methoxyethyl)-1-N,1-N-dimethyl-1-N'-prop-1-en-2-ylethane-1,1-diamine is sourced from PubChem (CID 175624615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).