N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine

C14H32N2O3 — CID 62559728

IUPACN-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
SMILESCCCCOCCNCCN(CCOC)CCOC
InChIInChI=1S/C14H32N2O3/c1-4-5-11-19-12-7-15-6-8-16(9-13-17-2)10-14-18-3/h15H,4-14H2,1-3H3
InChIKeyRHTUYPCBCVDVIG-UHFFFAOYSA-N
MW276.42 g/mol
LogP0.99
Rot. Bonds15

About N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine

N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine (PubChem CID 62559728) has the molecular formula C14H32N2O3 and a molecular weight of 276.42 g/mol. Its IUPAC name is N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
PubChem CID62559728
Molecular FormulaC14H32N2O3
Molecular Weight276.42 g/mol
Exact Mass276.24
IUPAC NameN-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
SMILESCCCCOCCNCCN(CCOC)CCOC
InChIInChI=1S/C14H32N2O3/c1-4-5-11-19-12-7-15-6-8-16(9-13-17-2)10-14-18-3/h15H,4-14H2,1-3H3
InChIKeyRHTUYPCBCVDVIG-UHFFFAOYSA-N
XLogP0.99
TPSA42.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-butoxyethyl)-N'-ethyl-N'-(2-methoxyethyl)ethane-1,2-diamine
CID 62554321
N'-butyl-N'-[2-(iodoamino)ethyl]-N-(2-methoxyethyl)ethane-1,2-diamine
CID 166766087
N'-butyl-N'-ethyl-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62575465
N-(2-hexoxyethyl)-3-methoxypropan-1-amine
CID 62599714
N',N'-dibutyl-N-(2-methoxyethyl)butane-1,4-diamine
CID 62569487
N',N'-dimethyl-N-(2-pentoxyethyl)ethane-1,2-diamine
CID 62584513
2-[2-(2-butoxyethoxy)ethoxy]-N-(2-iodoethyl)ethanamine
CID 114505577
N-(2-butoxyethyl)heptan-1-amine
CID 61168932
N-[2-(2-methoxyethoxy)ethyl]dodecan-1-amine
CID 63492773
N'-[2-(dimethylamino)ethyl]-N-(2-methoxyethyl)-N'-propylethane-1,2-diamine
CID 62574418
2-[2-[2-[2-butoxyethyl-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]amino]ethoxy]ethoxy]-N-methylethanamine
CID 174152104
ethane;N'-methyl-N-[2-(2-pentoxyethoxy)ethyl]-N'-propan-2-ylethane-1,2-diamine
CID 164907050

Frequently Asked Questions

What is the IUPAC name of N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine?
The IUPAC name of N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine (CID 62559728) is N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine.
What is the SMILES notation for N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine?
The canonical SMILES for N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine is CCCCOCCNCCN(CCOC)CCOC.
What is the InChIKey of N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine?
The InChIKey is RHTUYPCBCVDVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O3/c1-4-5-11-19-12-7-15-6-8-16(9-13-17-2)10-14-18-3/h15H,4-14H2,1-3H3.
What are the key properties of N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine?
N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine has a molecular weight of 276.42 g/mol, XLogP of 0.99, 15 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine is sourced from PubChem (CID 62559728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).