N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine

C17H37NO — CID 103031335

IUPACN-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine
SMILESCCNC(CCC(C)(C)OC)CC(C)CC(C)(C)C
InChIInChI=1S/C17H37NO/c1-9-18-15(10-11-17(6,7)19-8)12-14(2)13-16(3,4)5/h14-15,18H,9-13H2,1-8H3
InChIKeyGAEONSGXKGCKFN-UHFFFAOYSA-N
MW271.49 g/mol
LogP4.63
Rot. Bonds9

About N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine

N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine (PubChem CID 103031335) has the molecular formula C17H37NO and a molecular weight of 271.49 g/mol. Its IUPAC name is N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine.

Molecular Properties

Compound NameN-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine
PubChem CID103031335
Molecular FormulaC17H37NO
Molecular Weight271.49 g/mol
Exact Mass271.29
IUPAC NameN-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine
SMILESCCNC(CCC(C)(C)OC)CC(C)CC(C)(C)C
InChIInChI=1S/C17H37NO/c1-9-18-15(10-11-17(6,7)19-8)12-14(2)13-16(3,4)5/h14-15,18H,9-13H2,1-8H3
InChIKeyGAEONSGXKGCKFN-UHFFFAOYSA-N
XLogP4.63
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.49
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine?
The IUPAC name of N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine (CID 103031335) is N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine.
What is the SMILES notation for N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine?
The canonical SMILES for N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine is CCNC(CCC(C)(C)OC)CC(C)CC(C)(C)C.
What is the InChIKey of N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine?
The InChIKey is GAEONSGXKGCKFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37NO/c1-9-18-15(10-11-17(6,7)19-8)12-14(2)13-16(3,4)5/h14-15,18H,9-13H2,1-8H3.
What are the key properties of N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine?
N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine has a molecular weight of 271.49 g/mol, XLogP of 4.63, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methoxy-2,7,9,9-tetramethyldecan-5-amine is sourced from PubChem (CID 103031335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).