2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine

C17H37NO — CID 139968931

IUPAC2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine
SMILESCCCCCCCCC(COC)(CN(C)C)C(C)C
InChIInChI=1S/C17H37NO/c1-7-8-9-10-11-12-13-17(15-19-6,16(2)3)14-18(4)5/h16H,7-15H2,1-6H3
InChIKeyLEPKFFPUUYISGC-UHFFFAOYSA-N
MW271.49 g/mol
LogP4.59
Rot. Bonds12

About 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine

2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine (PubChem CID 139968931) has the molecular formula C17H37NO and a molecular weight of 271.49 g/mol. Its IUPAC name is 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine.

Molecular Properties

Compound Name2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine
PubChem CID139968931
Molecular FormulaC17H37NO
Molecular Weight271.49 g/mol
Exact Mass271.29
IUPAC Name2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine
SMILESCCCCCCCCC(COC)(CN(C)C)C(C)C
InChIInChI=1S/C17H37NO/c1-7-8-9-10-11-12-13-17(15-19-6,16(2)3)14-18(4)5/h16H,7-15H2,1-6H3
InChIKeyLEPKFFPUUYISGC-UHFFFAOYSA-N
XLogP4.59
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.49
LogP ≤ 54.59
H-Bond Donors ≤ 50
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)-N,N-dimethyl-2-propan-2-ylpentan-1-amine
CID 139968966
2-(methoxymethyl)-2-propan-2-yldecan-1-amine
CID 139968822
3,3-diethyl-2-methyldodecane
CID 151072312
5-ethyl-5-propan-2-yltetradecane
CID 123207557
2-hexyl-2-propan-2-ylpropane-1,3-diol
CID 79450743
2-heptyl-2-propan-2-ylpropane-1,3-diol
CID 79450915
2-decyl-2-propan-2-ylpropane-1,3-diol
CID 79450466
3,3-bis(methoxymethyl)-2-methylpentane
CID 89106557
2,3,3-trimethyloctadecane
CID 90966938
1,2,2-trimethoxyundecane
CID 151416745
2-(methoxymethyl)-N,N-dimethyl-2-propylpentan-1-amine
CID 71361648
3,3-difluoro-2-methylheptadecane
CID 22951834

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine?
The IUPAC name of 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine (CID 139968931) is 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine.
What is the SMILES notation for 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine?
The canonical SMILES for 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine is CCCCCCCCC(COC)(CN(C)C)C(C)C.
What is the InChIKey of 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine?
The InChIKey is LEPKFFPUUYISGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H37NO/c1-7-8-9-10-11-12-13-17(15-19-6,16(2)3)14-18(4)5/h16H,7-15H2,1-6H3.
What are the key properties of 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine?
2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine has a molecular weight of 271.49 g/mol, XLogP of 4.59, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N,N-dimethyl-2-propan-2-yldecan-1-amine is sourced from PubChem (CID 139968931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).