N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine

C16H35NO — CID 103032065

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

About N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine

N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine (PubChem CID 103032065) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine.

Molecular Properties

Compound NameN-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine
PubChem CID103032065
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC NameN-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine
SMILESCCNC(CCC(C)(C)OC)CC(C)C(C)(C)C
InChIInChI=1S/C16H35NO/c1-9-17-14(10-11-16(6,7)18-8)12-13(2)15(3,4)5/h13-14,17H,9-12H2,1-8H3
InChIKeyFQSHNFOGHLSNOO-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 N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine?
The IUPAC name of N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine (CID 103032065) is N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine.
What is the SMILES notation for N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine?
The canonical SMILES for N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine is CCNC(CCC(C)(C)OC)CC(C)C(C)(C)C.
What is the InChIKey of N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine?
The InChIKey is FQSHNFOGHLSNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-9-17-14(10-11-16(6,7)18-8)12-13(2)15(3,4)5/h13-14,17H,9-12H2,1-8H3.
What are the key properties of N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine?
N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-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 N-ethyl-8-methoxy-2,2,3,8-tetramethylnonan-5-amine is sourced from PubChem (CID 103032065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).