2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine

C16H35NO — CID 139968871

IUPAC2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine
SMILESCCCCCCCCC(CCC)(CNC)COC
InChIInChI=1S/C16H35NO/c1-5-7-8-9-10-11-13-16(12-6-2,14-17-3)15-18-4/h17H,5-15H2,1-4H3
InChIKeyXDHRUGJBQMVLJT-UHFFFAOYSA-N
MW257.46 g/mol
LogP4.39
Rot. Bonds13

About 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine

2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine (PubChem CID 139968871) has the molecular formula C16H35NO and a molecular weight of 257.46 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine
PubChem CID139968871
Molecular FormulaC16H35NO
Molecular Weight257.46 g/mol
Exact Mass257.27
IUPAC Name2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine
SMILESCCCCCCCCC(CCC)(CNC)COC
InChIInChI=1S/C16H35NO/c1-5-7-8-9-10-11-13-16(12-6-2,14-17-3)15-18-4/h17H,5-15H2,1-4H3
InChIKeyXDHRUGJBQMVLJT-UHFFFAOYSA-N
XLogP4.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.46
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(methoxymethyl)-2-propyldecan-1-amine
CID 139968844
4,4-bis(ethenoxymethyl)hexadecane
CID 126727088
N,N,2-triethyl-2-(methoxymethyl)decan-1-amine
CID 139968832
N,2,2-trimethyloctan-1-amine
CID 62723717
19-hexadecyl-19-nonylnonatriacontane
CID 90913331
6,6-dipentylpentadecane
CID 152650171
9,9-dioctyloctadecane
CID 19690418
8-hexyl-8-pentylhexadecane
CID 521602
2-(methoxymethyl)-2-(2-methylpropyl)decan-1-amine
CID 139968873
1,2,2-trimethoxyundecane
CID 151416745
10,10-dibutylicosane
CID 151498539
4,4-bis(bromomethyl)undecane
CID 79453128

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine?
The IUPAC name of 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine (CID 139968871) is 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine is CCCCCCCCC(CCC)(CNC)COC.
What is the InChIKey of 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine?
The InChIKey is XDHRUGJBQMVLJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO/c1-5-7-8-9-10-11-13-16(12-6-2,14-17-3)15-18-4/h17H,5-15H2,1-4H3.
What are the key properties of 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine?
2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine has a molecular weight of 257.46 g/mol, XLogP of 4.39, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-methyl-2-propyldecan-1-amine is sourced from PubChem (CID 139968871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).