N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine

C11H24N2O — CID 43608418

IUPACN',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CCOCC1
InChIInChI=1S/C11H24N2O/c1-3-13(4-2)8-7-12-11-5-9-14-10-6-11/h11-12H,3-10H2,1-2H3
InChIKeyCDYPJRSSWDJFKT-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.10
Rot. Bonds6

About N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine

N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine (PubChem CID 43608418) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine
PubChem CID43608418
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNC1CCOCC1
InChIInChI=1S/C11H24N2O/c1-3-13(4-2)8-7-12-11-5-9-14-10-6-11/h11-12H,3-10H2,1-2H3
InChIKeyCDYPJRSSWDJFKT-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine (CID 43608418) is N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine is CCN(CC)CCNC1CCOCC1.
What is the InChIKey of N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine?
The InChIKey is CDYPJRSSWDJFKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-13(4-2)8-7-12-11-5-9-14-10-6-11/h11-12H,3-10H2,1-2H3.
What are the key properties of N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine has a molecular weight of 200.33 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(oxan-4-yl)ethane-1,2-diamine is sourced from PubChem (CID 43608418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).