1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine

C14H19NO — CID 10656409

IUPAC1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine
SMILESC=C1CCN(Cc2ccc(OC)cc2)CC1
InChIInChI=1S/C14H19NO/c1-12-7-9-15(10-8-12)11-13-3-5-14(16-2)6-4-13/h3-6H,1,7-11H2,2H3
InChIKeyMIJFMDXFXKCNEU-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.85
Rot. Bonds3

About 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine

1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine (PubChem CID 10656409) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine.

Molecular Properties

Compound Name1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine
PubChem CID10656409
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine
SMILESC=C1CCN(Cc2ccc(OC)cc2)CC1
InChIInChI=1S/C14H19NO/c1-12-7-9-15(10-8-12)11-13-3-5-14(16-2)6-4-13/h3-6H,1,7-11H2,2H3
InChIKeyMIJFMDXFXKCNEU-UHFFFAOYSA-N
XLogP2.85
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,4,7-tris[(4-methoxyphenyl)methyl]-1,4,7-triazecane
CID 66887441
4-ethyl-1-[(4-methoxyphenyl)methyl]piperidine
CID 23381464
1-[(3-methoxyphenyl)methyl]-4-[(4-methoxyphenyl)methyl]piperazine
CID 2873492
1-[(4-methoxyphenyl)methyl]-4-prop-2-enyl-1,4-diazepane
CID 51075596
2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-2-methylpropanenitrile
CID 60702946
4-[(4-methoxyphenyl)methyl]piperazine-1-carboximidamide
CID 3043164
1,4-bis[(3,5-difluorophenyl)methyl]-7,10-bis[[4-[4-[[4,7,10-tris[(4-methoxyphenyl)methyl]-1,4,7,10-tetrazacyclododec-1-yl]methyl]phenyl]phenyl]methyl]-1,4,7,10-tetrazacyclododecane
CID 177488325
ethyl 2-[1-[(4-methoxyphenyl)methyl]piperidin-4-ylidene]acetate
CID 151101433
4-(4-methoxyphenyl)-1-[(4-methoxyphenyl)methyl]-5-phenyl-3,6-dihydro-2H-pyridine
CID 102519654
3-fluoro-1-[(4-methoxyphenyl)methyl]azetidine
CID 135395442
2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]ethanol
CID 10562587
2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]ethanamine
CID 15044920

Frequently Asked Questions

What is the IUPAC name of 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine?
The IUPAC name of 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine (CID 10656409) is 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine.
What is the SMILES notation for 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine?
The canonical SMILES for 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine is C=C1CCN(Cc2ccc(OC)cc2)CC1.
What is the InChIKey of 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine?
The InChIKey is MIJFMDXFXKCNEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-12-7-9-15(10-8-12)11-13-3-5-14(16-2)6-4-13/h3-6H,1,7-11H2,2H3.
What are the key properties of 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine?
1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine has a molecular weight of 217.31 g/mol, XLogP of 2.85, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-methoxyphenyl)methyl]-4-methylidenepiperidine is sourced from PubChem (CID 10656409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).