N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine

C14H32N2O2 — CID 106707937

IUPACN',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine
SMILESCOCCN(CCCCC(C)(C)CN)CCOC
InChIInChI=1S/C14H32N2O2/c1-14(2,13-15)7-5-6-8-16(9-11-17-3)10-12-18-4/h5-13,15H2,1-4H3
InChIKeyJDMDNIDDJYXKIO-UHFFFAOYSA-N
MW260.42 g/mol
LogP1.74
Rot. Bonds12

About N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine

N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine (PubChem CID 106707937) has the molecular formula C14H32N2O2 and a molecular weight of 260.42 g/mol. Its IUPAC name is N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine.

Molecular Properties

Compound NameN',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine
PubChem CID106707937
Molecular FormulaC14H32N2O2
Molecular Weight260.42 g/mol
Exact Mass260.25
IUPAC NameN',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine
SMILESCOCCN(CCCCC(C)(C)CN)CCOC
InChIInChI=1S/C14H32N2O2/c1-14(2,13-15)7-5-6-8-16(9-11-17-3)10-12-18-4/h5-13,15H2,1-4H3
InChIKeyJDMDNIDDJYXKIO-UHFFFAOYSA-N
XLogP1.74
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.42
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methoxy-2,2-dimethylhexan-1-amine
CID 104649285
N'-(2-methoxyethyl)-N'-(3-methoxypropyl)-2,2-dimethylpropane-1,3-diamine
CID 62260121
N'-(2-methoxyethyl)-N',2,2-trimethylpentane-1,5-diamine
CID 65254418
methyl 2-[(6-amino-5,5-dimethylhexyl)-(2-methoxy-2-oxoethyl)amino]acetate
CID 106708104
N'-(2-methoxyethyl)-3,3-dimethyl-N'-prop-2-enylhexane-1,6-diamine
CID 103339345
N-dodecyl-N-(2-methoxyethyl)dodecan-1-amine
CID 167224233
N-(2-methoxyethyl)-N-nonylnonan-1-amine
CID 6426107
N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride
CID 86811567
6-[ethyl(2-methoxyethyl)amino]-2,2-dimethylhexanenitrile
CID 106709904
5-[bis(2-methoxyethyl)amino]-N'-hydroxy-2,2-dimethylpentanimidamide
CID 77063702
3-(aminomethyl)-6-[ethyl(2-methoxyethyl)amino]hexan-3-ol
CID 106811257
5-chloro-N,N-bis(2-methoxyethyl)pentan-1-amine
CID 61418354

Frequently Asked Questions

What is the IUPAC name of N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine?
The IUPAC name of N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine (CID 106707937) is N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine.
What is the SMILES notation for N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine?
The canonical SMILES for N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine is COCCN(CCCCC(C)(C)CN)CCOC.
What is the InChIKey of N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine?
The InChIKey is JDMDNIDDJYXKIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32N2O2/c1-14(2,13-15)7-5-6-8-16(9-11-17-3)10-12-18-4/h5-13,15H2,1-4H3.
What are the key properties of N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine?
N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine has a molecular weight of 260.42 g/mol, XLogP of 1.74, 12 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-bis(2-methoxyethyl)-2,2-dimethylhexane-1,6-diamine is sourced from PubChem (CID 106707937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).