1-(3,5-dichlorophenyl)-4-methylpiperidine

C12H15Cl2N — CID 157277314

IUPAC1-(3,5-dichlorophenyl)-4-methylpiperidine
SMILESCC1CCN(c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C12H15Cl2N/c1-9-2-4-15(5-3-9)12-7-10(13)6-11(14)8-12/h6-9H,2-5H2,1H3
InChIKeyGOPUOCNKZMJQKT-UHFFFAOYSA-N
MW244.16 g/mol
LogP4.23
Rot. Bonds1

About 1-(3,5-dichlorophenyl)-4-methylpiperidine

1-(3,5-dichlorophenyl)-4-methylpiperidine (PubChem CID 157277314) has the molecular formula C12H15Cl2N and a molecular weight of 244.16 g/mol. Its IUPAC name is 1-(3,5-dichlorophenyl)-4-methylpiperidine.

Molecular Properties

Compound Name1-(3,5-dichlorophenyl)-4-methylpiperidine
PubChem CID157277314
Molecular FormulaC12H15Cl2N
Molecular Weight244.16 g/mol
Exact Mass243.06
IUPAC Name1-(3,5-dichlorophenyl)-4-methylpiperidine
SMILESCC1CCN(c2cc(Cl)cc(Cl)c2)CC1
InChIInChI=1S/C12H15Cl2N/c1-9-2-4-15(5-3-9)12-7-10(13)6-11(14)8-12/h6-9H,2-5H2,1H3
InChIKeyGOPUOCNKZMJQKT-UHFFFAOYSA-N
XLogP4.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.16
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3,5-dichlorophenyl)-N-methylpyrrolidin-3-amine
CID 60862129
3,5-dichloro-2-(4-methylpiperidin-1-yl)benzoic acid
CID 79686946
1-(3-chloro-5-fluorophenyl)-N-methylpiperidin-4-amine
CID 107366614
3-fluoro-5-(4-methylpiperidin-1-yl)aniline
CID 60874969
ethane;4-methyl-1-phenylpiperidine
CID 143180672
4,6-dichloro-2-(4-methylpiperidin-1-yl)pyrimidine
CID 25474747
3-(3,5-dichlorophenyl)-3-azabicyclo[4.1.0]heptane-7-carboxylic acid
CID 146382299
1-(3,5-dichlorophenyl)pyrrolidine-3-carboxamide
CID 117008210
2-fluoro-5-(4-methylpiperidin-1-yl)aniline
CID 79678383
1-(3-chloro-5-cyclopropylsulfonylphenyl)-4-methylpiperazine;1,3-dichloro-5-cyclopropylsulfonylbenzene
CID 158379676
N-(3,5-dichlorophenyl)-2-(4-methylpiperidin-1-yl)-2-oxoacetamide
CID 47336395
1-(3-chloro-4-fluorophenyl)-3-[4-(4-methylpiperidin-1-yl)phenyl]urea
CID 108991879

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dichlorophenyl)-4-methylpiperidine?
The IUPAC name of 1-(3,5-dichlorophenyl)-4-methylpiperidine (CID 157277314) is 1-(3,5-dichlorophenyl)-4-methylpiperidine.
What is the SMILES notation for 1-(3,5-dichlorophenyl)-4-methylpiperidine?
The canonical SMILES for 1-(3,5-dichlorophenyl)-4-methylpiperidine is CC1CCN(c2cc(Cl)cc(Cl)c2)CC1.
What is the InChIKey of 1-(3,5-dichlorophenyl)-4-methylpiperidine?
The InChIKey is GOPUOCNKZMJQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15Cl2N/c1-9-2-4-15(5-3-9)12-7-10(13)6-11(14)8-12/h6-9H,2-5H2,1H3.
What are the key properties of 1-(3,5-dichlorophenyl)-4-methylpiperidine?
1-(3,5-dichlorophenyl)-4-methylpiperidine has a molecular weight of 244.16 g/mol, XLogP of 4.23, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dichlorophenyl)-4-methylpiperidine is sourced from PubChem (CID 157277314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).