1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine

C18H30N2O — CID 102906308

IUPAC1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2ccccc2CCOC)CC1C
InChIInChI=1S/C18H30N2O/c1-4-11-19-17-9-12-20(14-15(17)2)18-8-6-5-7-16(18)10-13-21-3/h5-8,15,17,19H,4,9-14H2,1-3H3
InChIKeyOJUDFHKDLBNYPJ-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.09
Rot. Bonds7

About 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine

1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine (PubChem CID 102906308) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Name1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine
PubChem CID102906308
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine
SMILESCCCNC1CCN(c2ccccc2CCOC)CC1C
InChIInChI=1S/C18H30N2O/c1-4-11-19-17-9-12-20(14-15(17)2)18-8-6-5-7-16(18)10-13-21-3/h5-8,15,17,19H,4,9-14H2,1-3H3
InChIKeyOJUDFHKDLBNYPJ-UHFFFAOYSA-N
XLogP3.09
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-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

3-methyl-1-(4-methylphenyl)-N-propylpiperidin-4-amine
CID 54975533
1-(2-chlorophenyl)-N-ethyl-3-methylpiperidin-4-amine
CID 54975148
1-(4-bromophenyl)-3-methyl-N-propylpiperidin-4-amine
CID 54975299
1-(2,5-dichloro-4-methylphenyl)-3-methyl-N-propylpiperidin-4-amine
CID 104727298
1-(3-iodophenyl)-3-methyl-N-propylpiperidin-4-amine
CID 54976134
2-[2-(2-methoxyethyl)phenyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 102908462
3-methyl-N-propyl-1-thiophen-3-ylpiperidin-4-amine
CID 66349971
1-(3-ethyl-1-methylpyrazol-4-yl)-3-methyl-N-propylpiperidin-4-amine
CID 107463331
3-ethyl-1-[2-(2-methoxyethyl)phenyl]-1,4-diazepane
CID 102908437
1-(2-ethylphenyl)-2,3-dimethyl-N-propylpiperidin-4-amine
CID 79397422
N-[[2-(3-ethylpiperidin-1-yl)phenyl]methyl]-2-methoxyethanamine
CID 63059153
N-ethyl-1-(2-propylphenyl)piperidin-4-amine
CID 54963841

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine?
The IUPAC name of 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine (CID 102906308) is 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine.
What is the SMILES notation for 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine?
The canonical SMILES for 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine is CCCNC1CCN(c2ccccc2CCOC)CC1C.
What is the InChIKey of 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine?
The InChIKey is OJUDFHKDLBNYPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-4-11-19-17-9-12-20(14-15(17)2)18-8-6-5-7-16(18)10-13-21-3/h5-8,15,17,19H,4,9-14H2,1-3H3.
What are the key properties of 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine?
1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine has a molecular weight of 290.45 g/mol, XLogP of 3.09, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethyl)phenyl]-3-methyl-N-propylpiperidin-4-amine is sourced from PubChem (CID 102906308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).