N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine

C13H30N2O2 — CID 62560843

IUPACN',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
SMILESCCCC(C)NCCN(CCOC)CCOC
InChIInChI=1S/C13H30N2O2/c1-5-6-13(2)14-7-8-15(9-11-16-3)10-12-17-4/h13-14H,5-12H2,1-4H3
InChIKeyDZOVGGAFUOGUOG-UHFFFAOYSA-N
MW246.39 g/mol
LogP1.36
Rot. Bonds12

About N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine

N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine (PubChem CID 62560843) has the molecular formula C13H30N2O2 and a molecular weight of 246.39 g/mol. Its IUPAC name is N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
PubChem CID62560843
Molecular FormulaC13H30N2O2
Molecular Weight246.39 g/mol
Exact Mass246.23
IUPAC NameN',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
SMILESCCCC(C)NCCN(CCOC)CCOC
InChIInChI=1S/C13H30N2O2/c1-5-6-13(2)14-7-8-15(9-11-16-3)10-12-17-4/h13-14H,5-12H2,1-4H3
InChIKeyDZOVGGAFUOGUOG-UHFFFAOYSA-N
XLogP1.36
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butan-2-yl-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 61418838
N'-(1-cyclopropylethyl)-N'-(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
CID 62556804
N-(5-methylhexan-2-yl)-N',N'-dipropylethane-1,2-diamine
CID 62574843
N',N'-diethyl-N-[(2R)-1-methoxypropan-2-yl]ethane-1,2-diamine
CID 28571173
1-methoxy-4-(pentan-2-ylamino)butan-2-ol
CID 115897158
N',N'-diethyl-N-(4-methoxybutan-2-yl)butane-1,4-diamine
CID 115714050
N-butan-2-yl-N',N'-dipropylethane-1,2-diamine
CID 54809596
N-[2-[(2-methylpropan-2-yl)oxy]ethyl]pentan-2-amine
CID 62597643
N',N'-bis(2-methoxyethyl)-N-(2-methylpropyl)ethane-1,2-diamine
CID 62462476
2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine
CID 62043594
4-N-[2-(diethylamino)ethyl]-1-N,1-N-diethylpentane-1,4-diamine
CID 43199211
4-[bis(2-methoxyethyl)amino]-2-(ethylamino)butan-1-ol
CID 64827985

Frequently Asked Questions

What is the IUPAC name of N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine?
The IUPAC name of N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine (CID 62560843) is N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine.
What is the SMILES notation for N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine?
The canonical SMILES for N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine is CCCC(C)NCCN(CCOC)CCOC.
What is the InChIKey of N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine?
The InChIKey is DZOVGGAFUOGUOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O2/c1-5-6-13(2)14-7-8-15(9-11-16-3)10-12-17-4/h13-14H,5-12H2,1-4H3.
What are the key properties of N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine?
N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine has a molecular weight of 246.39 g/mol, XLogP of 1.36, 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)-N-pentan-2-ylethane-1,2-diamine is sourced from PubChem (CID 62560843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).