2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline

C16H26N2O — CID 115211539

IUPAC2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline
SMILESCOc1cc(C)cc(C)c1NCCC1CCNCC1
InChIInChI=1S/C16H26N2O/c1-12-10-13(2)16(15(11-12)19-3)18-9-6-14-4-7-17-8-5-14/h10-11,14,17-18H,4-9H2,1-3H3
InChIKeyHDBYTMHSHYOTEW-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.11
Rot. Bonds5

About 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline

2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline (PubChem CID 115211539) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline.

Molecular Properties

Compound Name2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline
PubChem CID115211539
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline
SMILESCOc1cc(C)cc(C)c1NCCC1CCNCC1
InChIInChI=1S/C16H26N2O/c1-12-10-13(2)16(15(11-12)19-3)18-9-6-14-4-7-17-8-5-14/h10-11,14,17-18H,4-9H2,1-3H3
InChIKeyHDBYTMHSHYOTEW-UHFFFAOYSA-N
XLogP3.11
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline 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

N-(2-chloroethyl)-2-methoxy-4,6-dimethylaniline
CID 115214635
N'-(2-methoxy-4,6-dimethylphenyl)methanediamine
CID 115225448
4-[(2,3-dimethoxy-5-methylphenyl)methyl]piperidine
CID 117377234
4-(fluoromethyl)-2-methyl-N-(2-piperidin-4-ylethyl)aniline
CID 115054203
5-methyl-N-(2-piperidin-4-ylethyl)pyrimidin-2-amine
CID 116975989
4-[(2-bromo-6-methoxy-4-methylphenyl)methyl]piperidine
CID 84815988
4-[(2-bromo-3-methoxy-5-methylphenyl)methyl]piperidine
CID 84815999
1-N-(2-methoxy-4,6-dimethylphenyl)pentane-1,4-diamine
CID 115203619
1-N-(2,4-dimethoxy-6-methylphenyl)-3-methylbutane-1,3-diamine
CID 115200420
5-methoxy-1-methyl-N-(2-piperidin-4-ylethyl)pyrazol-3-amine
CID 114256042
N-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]pyrrolidin-3-amine
CID 115119043
N-[(4-methoxy-3-methylphenyl)methyl]-1-piperidin-4-ylmethanamine
CID 115209928

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline?
The IUPAC name of 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline (CID 115211539) is 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline.
What is the SMILES notation for 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline?
The canonical SMILES for 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline is COc1cc(C)cc(C)c1NCCC1CCNCC1.
What is the InChIKey of 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline?
The InChIKey is HDBYTMHSHYOTEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-12-10-13(2)16(15(11-12)19-3)18-9-6-14-4-7-17-8-5-14/h10-11,14,17-18H,4-9H2,1-3H3.
What are the key properties of 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline?
2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline has a molecular weight of 262.40 g/mol, XLogP of 3.11, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4,6-dimethyl-N-(2-piperidin-4-ylethyl)aniline is sourced from PubChem (CID 115211539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).