5-methoxy-N-methyl-2-phenylpentan-1-amine

C13H21NO — CID 65430583

IUPAC5-methoxy-N-methyl-2-phenylpentan-1-amine
SMILESCNCC(CCCOC)c1ccccc1
InChIInChI=1S/C13H21NO/c1-14-11-13(9-6-10-15-2)12-7-4-3-5-8-12/h3-5,7-8,13-14H,6,9-11H2,1-2H3
InChIKeyVYRGWQLPXVFPCS-UHFFFAOYSA-N
MW207.32 g/mol
LogP2.42
Rot. Bonds7

About 5-methoxy-N-methyl-2-phenylpentan-1-amine

5-methoxy-N-methyl-2-phenylpentan-1-amine (PubChem CID 65430583) has the molecular formula C13H21NO and a molecular weight of 207.32 g/mol. Its IUPAC name is 5-methoxy-N-methyl-2-phenylpentan-1-amine.

Molecular Properties

Compound Name5-methoxy-N-methyl-2-phenylpentan-1-amine
PubChem CID65430583
Molecular FormulaC13H21NO
Molecular Weight207.32 g/mol
Exact Mass207.16
IUPAC Name5-methoxy-N-methyl-2-phenylpentan-1-amine
SMILESCNCC(CCCOC)c1ccccc1
InChIInChI=1S/C13H21NO/c1-14-11-13(9-6-10-15-2)12-7-4-3-5-8-12/h3-5,7-8,13-14H,6,9-11H2,1-2H3
InChIKeyVYRGWQLPXVFPCS-UHFFFAOYSA-N
XLogP2.42
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 52.42
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

5-(2-methoxyethoxy)-N-methyl-2-phenylpentan-1-amine
CID 103412550
N-ethyl-6-methoxy-2-phenylhexan-1-amine
CID 81024742
N-tert-butyl-6-methoxy-2-phenylhexan-1-amine
CID 81024230
N-(2-methoxyethyl)-2-phenylpentan-1-amine
CID 65431371
2-(4-chlorophenyl)-4-methoxy-N-methylbutan-1-amine
CID 79441568
5-ethoxy-N-ethyl-2-phenylpentan-1-amine
CID 65430782
5-ethylsulfonyl-N-(2-methoxyethyl)-2-phenylpentan-1-amine
CID 65430810
2-(3-bromophenyl)-N-methyl-5-phenoxypentan-1-amine
CID 79430860
N-methyl-2-phenyl-N'-(3-phenylpropyl)pentane-1,5-diamine
CID 70494547
N-ethyl-4-(2-methoxyethoxy)-2-phenylbutan-1-amine
CID 65430591
(2S)-2-(cyclodecapentaenyl)-N-methylpropan-1-amine
CID 166722722
2-(3-bromophenyl)-N-ethyl-5-methoxypentan-1-amine
CID 79442906

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-methyl-2-phenylpentan-1-amine?
The IUPAC name of 5-methoxy-N-methyl-2-phenylpentan-1-amine (CID 65430583) is 5-methoxy-N-methyl-2-phenylpentan-1-amine.
What is the SMILES notation for 5-methoxy-N-methyl-2-phenylpentan-1-amine?
The canonical SMILES for 5-methoxy-N-methyl-2-phenylpentan-1-amine is CNCC(CCCOC)c1ccccc1.
What is the InChIKey of 5-methoxy-N-methyl-2-phenylpentan-1-amine?
The InChIKey is VYRGWQLPXVFPCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO/c1-14-11-13(9-6-10-15-2)12-7-4-3-5-8-12/h3-5,7-8,13-14H,6,9-11H2,1-2H3.
What are the key properties of 5-methoxy-N-methyl-2-phenylpentan-1-amine?
5-methoxy-N-methyl-2-phenylpentan-1-amine has a molecular weight of 207.32 g/mol, XLogP of 2.42, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-methyl-2-phenylpentan-1-amine is sourced from PubChem (CID 65430583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).