N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen

C15H35NO4 — CID 156794535

IUPACN-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen
SMILESCCOCCOCCOCCOCCNCC(C)CC.[H][H]
InChIInChI=1S/C15H33NO4.H2/c1-4-15(3)14-16-6-7-18-10-11-20-13-12-19-9-8-17-5-2;/h15-16H,4-14H2,1-3H3;1H
InChIKeyHDPMHAYHHXUQGR-UHFFFAOYSA-N
MW293.45 g/mol
LogP1.95
Rot. Bonds16

About N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen

N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen (PubChem CID 156794535) has the molecular formula C15H35NO4 and a molecular weight of 293.45 g/mol. Its IUPAC name is N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen.

Molecular Properties

Compound NameN-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen
PubChem CID156794535
Molecular FormulaC15H35NO4
Molecular Weight293.45 g/mol
Exact Mass293.26
IUPAC NameN-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen
SMILESCCOCCOCCOCCOCCNCC(C)CC.[H][H]
InChIInChI=1S/C15H33NO4.H2/c1-4-15(3)14-16-6-7-18-10-11-20-13-12-19-9-8-17-5-2;/h15-16H,4-14H2,1-3H3;1H
InChIKeyHDPMHAYHHXUQGR-UHFFFAOYSA-N
XLogP1.95
TPSA48.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.45
LogP ≤ 51.95
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-[2-(2-methoxyethoxy)ethoxy]ethyl]-2-methylbutan-1-amine
CID 104562209
2-methyl-N-[2-[2-[2-[2-(4-methylhex-2-ynoxy)ethoxy]ethoxy]ethoxy]ethyl]butan-1-amine;molecular hydrogen
CID 156795110
2-methyl-N-[2-[2-(4-methylpentoxy)ethoxy]ethyl]butan-1-amine
CID 142623041
2-methyl-N-(2-undecoxyethyl)butan-1-amine
CID 22091443
N-(2-ethoxyethyl)-2-methylpropan-1-amine
CID 43387935
2-methyl-N-[2-[2-[2-[2-(3-phenoxypropoxy)ethoxy]ethoxy]ethoxy]ethyl]butan-1-amine;molecular hydrogen
CID 177320418
1-(2-ethoxyethylamino)propan-2-ol
CID 43393547
N-[2-(cyclopropylmethoxy)ethyl]-2-methylbutan-1-amine
CID 103897079
N'-[2-(2-methylbutylamino)ethyl]-N-[2-[2-(2-methylbutylamino)ethylamino]ethyl]ethane-1,2-diamine
CID 87768020
N-(2-ethoxyethyl)-2,3,3-trimethylbutan-1-amine
CID 83143749
N-[2-(2-ethoxyethoxy)ethyl]butan-2-amine
CID 62565963
N-[2-[2-[2-[2-(3-methylpentoxy)ethoxy]ethoxy]ethoxy]ethyl]propan-1-amine
CID 178164668

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen?
The IUPAC name of N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen (CID 156794535) is N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen.
What is the SMILES notation for N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen?
The canonical SMILES for N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen is CCOCCOCCOCCOCCNCC(C)CC.[H][H].
What is the InChIKey of N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen?
The InChIKey is HDPMHAYHHXUQGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO4.H2/c1-4-15(3)14-16-6-7-18-10-11-20-13-12-19-9-8-17-5-2;/h15-16H,4-14H2,1-3H3;1H.
What are the key properties of N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen?
N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen has a molecular weight of 293.45 g/mol, XLogP of 1.95, 16 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-2-methylbutan-1-amine;molecular hydrogen is sourced from PubChem (CID 156794535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).