2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine

C13H30N2O2 — CID 62043594

IUPAC2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine
SMILESCCCC(CN(CCOC)CCOC)NCC
InChIInChI=1S/C13H30N2O2/c1-5-7-13(14-6-2)12-15(8-10-16-3)9-11-17-4/h13-14H,5-12H2,1-4H3
InChIKeyVUKKBDILWYTNTL-UHFFFAOYSA-N
MW246.39 g/mol
LogP1.36
Rot. Bonds12

About 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine

2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine (PubChem CID 62043594) has the molecular formula C13H30N2O2 and a molecular weight of 246.39 g/mol. Its IUPAC name is 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine
PubChem CID62043594
Molecular FormulaC13H30N2O2
Molecular Weight246.39 g/mol
Exact Mass246.23
IUPAC Name2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine
SMILESCCCC(CN(CCOC)CCOC)NCC
InChIInChI=1S/C13H30N2O2/c1-5-7-13(14-6-2)12-15(8-10-16-3)9-11-17-4/h13-14H,5-12H2,1-4H3
InChIKeyVUKKBDILWYTNTL-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

1-N,1-N-bis(2-methoxyethyl)-2-N-propylbutane-1,2-diamine
CID 62040984
4-[bis(2-methoxyethyl)amino]-2-(ethylamino)butan-1-ol
CID 64827985
4-(dipropylamino)-3-(ethylamino)butan-1-ol
CID 64899669
N-ethyl-10-methoxydecan-4-amine
CID 104650043
2-N-ethyl-1-N-propyl-1-N-(2,2,2-trifluoroethyl)pentane-1,2-diamine
CID 62044491
2-N-ethyl-1-N-methyl-1-N-(2-propan-2-yloxyethyl)pentane-1,2-diamine
CID 81056584
N',N'-bis(2-methoxyethyl)-N-pentan-2-ylethane-1,2-diamine
CID 62560843
1-N-ethyl-1-N-(2-methoxyethyl)-2-N-methylbutane-1,2-diamine
CID 62038439
2-N-ethyl-3-methoxy-1-N-(3-methoxypropyl)-1-N-methylpropane-1,2-diamine
CID 107505693
N-ethyl-1-(3-methoxypropylsulfinyl)pentan-2-amine
CID 64660381
4-[2-methoxyethyl(3-methoxypropyl)amino]-3-(methylamino)butan-1-ol
CID 64899469
N-ethyl-1-(3-methoxypropylsulfonyl)pentan-2-amine
CID 64675460

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine?
The IUPAC name of 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine (CID 62043594) is 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine is CCCC(CN(CCOC)CCOC)NCC.
What is the InChIKey of 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine?
The InChIKey is VUKKBDILWYTNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O2/c1-5-7-13(14-6-2)12-15(8-10-16-3)9-11-17-4/h13-14H,5-12H2,1-4H3.
What are the key properties of 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine?
2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-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 2-N-ethyl-1-N,1-N-bis(2-methoxyethyl)pentane-1,2-diamine is sourced from PubChem (CID 62043594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).