[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine

C14H22N2O — CID 102956590

IUPAC[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine
SMILESCOC1CCCN(Cc2cccc(CN)c2)C1
InChIInChI=1S/C14H22N2O/c1-17-14-6-3-7-16(11-14)10-13-5-2-4-12(8-13)9-15/h2,4-5,8,14H,3,6-7,9-11,15H2,1H3
InChIKeySNWQBGWHDZRQAS-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.76
Rot. Bonds4

About [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine

[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine (PubChem CID 102956590) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine.

Molecular Properties

Compound Name[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine
PubChem CID102956590
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine
SMILESCOC1CCCN(Cc2cccc(CN)c2)C1
InChIInChI=1S/C14H22N2O/c1-17-14-6-3-7-16(11-14)10-13-5-2-4-12(8-13)9-15/h2,4-5,8,14H,3,6-7,9-11,15H2,1H3
InChIKeySNWQBGWHDZRQAS-UHFFFAOYSA-N
XLogP1.76
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine 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

ethane;[3-[3-[3-(3-methoxypiperidin-1-yl)propoxy]propyl]phenyl]methanamine
CID 142364751
[4-[(3-methoxypyrrolidin-1-yl)methyl]phenyl]methanamine
CID 103531169
N-[[3-[(3-methoxypyrrolidin-1-yl)methyl]phenyl]methyl]cyclopropanamine
CID 103539708
1-[[3-(aminomethyl)phenyl]methyl]-3-methylpiperidin-4-ol
CID 114678032
[3-[(3-methylpyrrolidin-1-yl)methyl]phenyl]methanamine
CID 61224005
N-[3-(aminomethyl)phenyl]-3-(3-methoxypiperidin-1-yl)propanamide
CID 102956603
(3S)-1-[(3-bromophenyl)methyl]-3-methoxypyrrolidine
CID 172647705
1-[(4-iodophenyl)methyl]-3-methoxypiperidine
CID 103713929
4-[(3-methoxypiperidin-1-yl)methyl]pyridine
CID 131702809
1-[(5-bromofuran-3-yl)methyl]-3-methoxypiperidine
CID 130727806
1-benzyl-4-[2-(3-methoxypiperidin-1-yl)ethyl]piperazine
CID 91837664
[2-[(3-methoxypiperidin-1-yl)methyl]furan-3-yl]methanamine
CID 102968055

Frequently Asked Questions

What is the IUPAC name of [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine?
The IUPAC name of [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine (CID 102956590) is [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine.
What is the SMILES notation for [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine?
The canonical SMILES for [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine is COC1CCCN(Cc2cccc(CN)c2)C1.
What is the InChIKey of [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine?
The InChIKey is SNWQBGWHDZRQAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-17-14-6-3-7-16(11-14)10-13-5-2-4-12(8-13)9-15/h2,4-5,8,14H,3,6-7,9-11,15H2,1H3.
What are the key properties of [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine?
[3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine has a molecular weight of 234.34 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(3-methoxypiperidin-1-yl)methyl]phenyl]methanamine is sourced from PubChem (CID 102956590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).