2-methoxy-N,2-dimethylundecan-4-amine

C14H31NO — CID 103025042

IUPAC2-methoxy-N,2-dimethylundecan-4-amine
SMILESCCCCCCCC(CC(C)(C)OC)NC
InChIInChI=1S/C14H31NO/c1-6-7-8-9-10-11-13(15-4)12-14(2,3)16-5/h13,15H,6-12H2,1-5H3
InChIKeyFICKWBDJCHSGAJ-UHFFFAOYSA-N
MW229.41 g/mol
LogP3.75
Rot. Bonds10

About 2-methoxy-N,2-dimethylundecan-4-amine

2-methoxy-N,2-dimethylundecan-4-amine (PubChem CID 103025042) has the molecular formula C14H31NO and a molecular weight of 229.41 g/mol. Its IUPAC name is 2-methoxy-N,2-dimethylundecan-4-amine.

Molecular Properties

Compound Name2-methoxy-N,2-dimethylundecan-4-amine
PubChem CID103025042
Molecular FormulaC14H31NO
Molecular Weight229.41 g/mol
Exact Mass229.24
IUPAC Name2-methoxy-N,2-dimethylundecan-4-amine
SMILESCCCCCCCC(CC(C)(C)OC)NC
InChIInChI=1S/C14H31NO/c1-6-7-8-9-10-11-13(15-4)12-14(2,3)16-5/h13,15H,6-12H2,1-5H3
InChIKeyFICKWBDJCHSGAJ-UHFFFAOYSA-N
XLogP3.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.41
LogP ≤ 53.75
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

Hexylamine, 5-methoxy-N,1,5-trimethyl-, hydrochloride
CID 44690
6-methoxy-N,6-dimethylheptan-2-amine
CID 44691
1,1,1-trifluoro-6-methoxy-N,6-dimethylheptan-4-amine
CID 103027353
8,8,8-trifluoro-2-methoxy-N,2-dimethyloctan-4-amine
CID 103028745
1,1,1-trifluoro-7-methoxy-7-methyl-N-propyloctan-4-amine
CID 103031726
N-ethyl-1,1,1-trifluoro-7-methoxy-7-methyloctan-4-amine
CID 103031882
1,1,1-trifluoro-7-methoxy-N,7-dimethyloctan-4-amine
CID 103032392
5,5,5-trifluoro-1-(1-methoxycyclobutyl)-N-methylpentan-2-amine
CID 103559452
N-ethyl-6,6,6-trifluoro-1-(1-methoxycyclobutyl)hexan-2-amine
CID 103559715
6,6,6-trifluoro-1-(1-methoxycyclobutyl)-N-propylhexan-2-amine
CID 103559716
6,6,6-trifluoro-1-(1-methoxycyclobutyl)-N-methylhexan-2-amine
CID 103559717
N-ethyl-8,8,8-trifluoro-2-methoxy-2-methyloctan-4-amine
CID 113766524

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,2-dimethylundecan-4-amine?
The IUPAC name of 2-methoxy-N,2-dimethylundecan-4-amine (CID 103025042) is 2-methoxy-N,2-dimethylundecan-4-amine.
What is the SMILES notation for 2-methoxy-N,2-dimethylundecan-4-amine?
The canonical SMILES for 2-methoxy-N,2-dimethylundecan-4-amine is CCCCCCCC(CC(C)(C)OC)NC.
What is the InChIKey of 2-methoxy-N,2-dimethylundecan-4-amine?
The InChIKey is FICKWBDJCHSGAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO/c1-6-7-8-9-10-11-13(15-4)12-14(2,3)16-5/h13,15H,6-12H2,1-5H3.
What are the key properties of 2-methoxy-N,2-dimethylundecan-4-amine?
2-methoxy-N,2-dimethylundecan-4-amine has a molecular weight of 229.41 g/mol, XLogP of 3.75, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,2-dimethylundecan-4-amine is sourced from PubChem (CID 103025042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).