3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine

C17H29NO3 — CID 105028365

IUPAC3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine
SMILESCCC(CC)CC(NC)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C17H29NO3/c1-7-12(8-2)9-14(18-3)13-10-15(19-4)17(21-6)16(11-13)20-5/h10-12,14,18H,7-9H2,1-6H3
InChIKeyMAPZJISKIBCFCO-UHFFFAOYSA-N
MW295.42 g/mol
LogP3.80
Rot. Bonds9

About 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine

3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine (PubChem CID 105028365) has the molecular formula C17H29NO3 and a molecular weight of 295.42 g/mol. Its IUPAC name is 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine.

Molecular Properties

Compound Name3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine
PubChem CID105028365
Molecular FormulaC17H29NO3
Molecular Weight295.42 g/mol
Exact Mass295.21
IUPAC Name3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine
SMILESCCC(CC)CC(NC)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C17H29NO3/c1-7-12(8-2)9-14(18-3)13-10-15(19-4)17(21-6)16(11-13)20-5/h10-12,14,18H,7-9H2,1-6H3
InChIKeyMAPZJISKIBCFCO-UHFFFAOYSA-N
XLogP3.80
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.42
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-chloro-4,5-dimethoxyphenyl)-3-ethyl-N-methylpentan-1-amine
CID 82923305
[3-ethyl-1-(3,4,5-trimethoxyphenyl)pentyl]hydrazine
CID 105330965
N,N'-dimethyl-1-(3,4,5-trimethoxyphenyl)propane-1,3-diamine
CID 116948624
1-(3,5-difluorophenyl)-3-ethyl-N-methylpentan-1-amine
CID 82922686
1-(2,6-dimethyl-4-pyridinyl)-3-ethyl-N-methylpentan-1-amine
CID 107503549
N,N'-dimethyl-1-(3,4,5-trimethoxyphenyl)methanediamine
CID 116954412
2-(furan-3-yl)-N-methyl-1-(3,4,5-trimethoxyphenyl)ethanamine
CID 105030112
N-methyl-4-(3,4,5-trimethoxyphenyl)hexan-3-amine
CID 22163988
1-(4-methoxy-3,5-dimethylphenyl)-N-methylpropan-1-amine
CID 83056847
1-(3-chloro-4,5-dimethoxyphenyl)-2-ethoxy-N-methylethanamine
CID 79575404
N,N',N'-trimethyl-1-(3,4,5-trimethoxyphenyl)methanediamine
CID 116909317
[5-methyl-1-(3,4,5-trimethoxyphenyl)hexyl]hydrazine
CID 105331209

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine?
The IUPAC name of 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine (CID 105028365) is 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine.
What is the SMILES notation for 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine?
The canonical SMILES for 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine is CCC(CC)CC(NC)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine?
The InChIKey is MAPZJISKIBCFCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO3/c1-7-12(8-2)9-14(18-3)13-10-15(19-4)17(21-6)16(11-13)20-5/h10-12,14,18H,7-9H2,1-6H3.
What are the key properties of 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine?
3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine has a molecular weight of 295.42 g/mol, XLogP of 3.80, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-N-methyl-1-(3,4,5-trimethoxyphenyl)pentan-1-amine is sourced from PubChem (CID 105028365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).