(3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine

C12H15Cl2N — CID 95456606

IUPAC(3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine
SMILESC[C@]1(c2ccc(Cl)c(Cl)c2)CCCNC1
InChIInChI=1S/C12H15Cl2N/c1-12(5-2-6-15-8-12)9-3-4-10(13)11(14)7-9/h3-4,7,15H,2,5-6,8H2,1H3/t12-/m0/s1
InChIKeyMZCJLBZIZZMTFH-LBPRGKRZSA-N
MW244.16 g/mol
LogP3.63
Rot. Bonds1

About (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine

(3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine (PubChem CID 95456606) has the molecular formula C12H15Cl2N and a molecular weight of 244.16 g/mol. Its IUPAC name is (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine.

Molecular Properties

Compound Name(3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine
PubChem CID95456606
Molecular FormulaC12H15Cl2N
Molecular Weight244.16 g/mol
Exact Mass243.06
IUPAC Name(3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine
SMILESC[C@]1(c2ccc(Cl)c(Cl)c2)CCCNC1
InChIInChI=1S/C12H15Cl2N/c1-12(5-2-6-15-8-12)9-3-4-10(13)11(14)7-9/h3-4,7,15H,2,5-6,8H2,1H3/t12-/m0/s1
InChIKeyMZCJLBZIZZMTFH-LBPRGKRZSA-N
XLogP3.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.16
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-cyclopropylphenyl)-3-methylpiperidine
CID 117050274
3-(1,3-benzodioxol-5-yl)-3-methylpiperidine
CID 82285836
(3S)-3-(3,4-dichlorophenyl)-3-(methoxymethyl)piperidine
CID 46245101
1,2-dichloro-4-(1-methylcyclopropyl)benzene;ethane;propane
CID 143403247
3-[(3S)-3-(3,4-dichlorophenyl)piperidin-3-yl]propan-1-ol
CID 11119744
3-[(3S)-3-(3,4-dichlorophenyl)piperidin-3-yl]propanenitrile
CID 46245018
[3-(3,4-dichlorophenyl)piperidin-3-yl]methyl N-methylcarbamate
CID 68653852
N-[2-[(3S)-3-(3,4-dichlorophenyl)piperidin-3-yl]ethyl]-N-methylmethanesulfonamide
CID 46244927
2-[(3S)-3-(3,4-dichlorophenyl)piperidin-3-yl]-N-(2-methoxyethyl)ethanamine
CID 46245260
4-(3,4-dichlorophenyl)piperidin-4-amine
CID 118021104
1-(3,4-dichlorophenyl)cycloheptan-1-amine
CID 43164287
(1R,6S)-1-(3,4-dichlorophenyl)-3-azabicyclo[4.1.0]heptane
CID 24849583

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine?
The IUPAC name of (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine (CID 95456606) is (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine.
What is the SMILES notation for (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine?
The canonical SMILES for (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine is C[C@]1(c2ccc(Cl)c(Cl)c2)CCCNC1.
What is the InChIKey of (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine?
The InChIKey is MZCJLBZIZZMTFH-LBPRGKRZSA-N. The full InChI is InChI=1S/C12H15Cl2N/c1-12(5-2-6-15-8-12)9-3-4-10(13)11(14)7-9/h3-4,7,15H,2,5-6,8H2,1H3/t12-/m0/s1.
What are the key properties of (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine?
(3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine has a molecular weight of 244.16 g/mol, XLogP of 3.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(3,4-dichlorophenyl)-3-methylpiperidine is sourced from PubChem (CID 95456606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).