N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine

C12H26N2O — CID 43534143

IUPACN',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine
SMILESCCN(CC)CCNC(C)C1CCCO1
InChIInChI=1S/C12H26N2O/c1-4-14(5-2)9-8-13-11(3)12-7-6-10-15-12/h11-13H,4-10H2,1-3H3
InChIKeyYUVJXFHZUKWSDM-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds7

About N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine

N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine (PubChem CID 43534143) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine
PubChem CID43534143
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine
SMILESCCN(CC)CCNC(C)C1CCCO1
InChIInChI=1S/C12H26N2O/c1-4-14(5-2)9-8-13-11(3)12-7-6-10-15-12/h11-13H,4-10H2,1-3H3
InChIKeyYUVJXFHZUKWSDM-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Isopropyl-(tetrahydro-furan-2-ylmethyl)-amine
CID 263171
1,2-Propanediamine, 2-methyl-N-(tetrahydrofurfuryl)-
CID 3057146
(2-Aminoethyl)(methyl)((oxolan-2-yl)methyl)amine
CID 43373754
N1,N1-Dimethyl-N2-((tetrahydrofuran-2-yl)methyl)ethane-1,2-diamine
CID 18524092
Methyl(1-(oxolan-2-yl)ethyl)amine
CID 43534145
N-tetrahydrofurfurylethylenediamine
CID 13802796
N-[(oxolan-2-yl)methyl]azetidin-3-amine
CID 65958854
(2-Aminoethyl)[2,2,2-trifluoro-1-(oxolan-2-yl)ethyl]amine
CID 54594390
N-[[5-(methylaminomethyl)oxolan-2-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 55073913
2-N-ethyl-2-N-(oxolan-2-ylmethyl)-1-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 55087708
1-N-(oxolan-2-ylmethyl)-2-N-propan-2-yl-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 55087752
2-N-methyl-1-N-(oxolan-2-ylmethyl)-2-N-(2,2,2-trifluoroethyl)propane-1,2-diamine
CID 55087799

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine (CID 43534143) is N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine is CCN(CC)CCNC(C)C1CCCO1.
What is the InChIKey of N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine?
The InChIKey is YUVJXFHZUKWSDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-4-14(5-2)9-8-13-11(3)12-7-6-10-15-12/h11-13H,4-10H2,1-3H3.
What are the key properties of N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine?
N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine is sourced from PubChem (CID 43534143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).