2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine

C16H35NO — CID 103031151

IUPAC2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine
SMILESCNC(CCC(C)(C)OC)CC(C)CC(C)(C)C
InChIInChI=1S/C16H35NO/c1-13(12-15(2,3)4)11-14(17-7)9-10-16(5,6)18-8/h13-14,17H,9-12H2,1-8H3
InChIKeyFIIUKKOMZSEAEL-UHFFFAOYSA-N
MW257.46 g/mol
LogP4.24
Rot. Bonds8

About 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine

2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine (PubChem CID 103031151) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine.

Molecular Properties

Compound Name2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine
PubChem CID103031151
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC Name2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine
SMILESCNC(CCC(C)(C)OC)CC(C)CC(C)(C)C
InChIInChI=1S/C16H35NO/c1-13(12-15(2,3)4)11-14(17-7)9-10-16(5,6)18-8/h13-14,17H,9-12H2,1-8H3
InChIKeyFIIUKKOMZSEAEL-UHFFFAOYSA-N
XLogP4.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine?
The IUPAC name of 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine (CID 103031151) is 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine.
What is the SMILES notation for 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine?
The canonical SMILES for 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine is CNC(CCC(C)(C)OC)CC(C)CC(C)(C)C.
What is the InChIKey of 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine?
The InChIKey is FIIUKKOMZSEAEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-13(12-15(2,3)4)11-14(17-7)9-10-16(5,6)18-8/h13-14,17H,9-12H2,1-8H3.
What are the key properties of 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine?
2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine has a molecular weight of 257.46 g/mol, XLogP of 4.24, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,2,7,9,9-pentamethyldecan-5-amine is sourced from PubChem (CID 103031151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).