N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine

C15H25NO3 — CID 65300910

IUPACN-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine
SMILESCNCCCCCc1c(OC)cc(OC)cc1OC
InChIInChI=1S/C15H25NO3/c1-16-9-7-5-6-8-13-14(18-3)10-12(17-2)11-15(13)19-4/h10-11,16H,5-9H2,1-4H3
InChIKeyFJGVLADRQLULMV-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.64
Rot. Bonds9

About N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine

N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine (PubChem CID 65300910) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine.

Molecular Properties

Compound NameN-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine
PubChem CID65300910
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC NameN-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine
SMILESCNCCCCCc1c(OC)cc(OC)cc1OC
InChIInChI=1S/C15H25NO3/c1-16-9-7-5-6-8-13-14(18-3)10-12(17-2)11-15(13)19-4/h10-11,16H,5-9H2,1-4H3
InChIKeyFJGVLADRQLULMV-UHFFFAOYSA-N
XLogP2.64
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(5-bromopentyl)-1,3,5-trimethoxybenzene
CID 56956628
4-(methylamino)-N-[2-(2,4,6-trimethoxyphenyl)ethyl]butanamide
CID 119778871
2-(2-bromo-4,6-dimethoxyphenyl)-N-methylethanamine
CID 117437716
N-methyl-N'-[(2,4,6-trimethoxyphenyl)methyl]ethane-1,2-diamine
CID 115195875
N'-[2-(2,4,6-trimethoxyphenyl)ethyl]propane-1,3-diamine
CID 115197367
N-[(2,4,6-trimethoxyphenyl)methyl]pentan-1-amine
CID 43090921
5-(4-methoxyphenoxy)-N-methylpentan-1-amine
CID 62458714
methyl 3-(2,4,6-trimethoxyphenyl)propanoate
CID 25107739
1,3,5-trimethoxy-2-[[2-methoxy-5-methyl-3-[(2,4,6-trimethoxyphenyl)methyl]phenyl]methyl]benzene
CID 22900363
2-(2,6-dichloro-4-methoxyphenyl)-N-methylethanamine
CID 84796736
2-(iodomethyl)-1,3,5-trimethoxybenzene
CID 10946751
N,N'-dimethyl-1-(2,4,6-trimethoxyphenyl)propane-1,3-diamine
CID 116948588

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine?
The IUPAC name of N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine (CID 65300910) is N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine.
What is the SMILES notation for N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine?
The canonical SMILES for N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine is CNCCCCCc1c(OC)cc(OC)cc1OC.
What is the InChIKey of N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine?
The InChIKey is FJGVLADRQLULMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-16-9-7-5-6-8-13-14(18-3)10-12(17-2)11-15(13)19-4/h10-11,16H,5-9H2,1-4H3.
What are the key properties of N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine?
N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.64, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(2,4,6-trimethoxyphenyl)pentan-1-amine is sourced from PubChem (CID 65300910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).