(4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine

C15H22ClN — CID 70966986

IUPAC(4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine
SMILESCC(C)C1CN(C)CC[C@H]1c1ccc(Cl)cc1
InChIInChI=1S/C15H22ClN/c1-11(2)15-10-17(3)9-8-14(15)12-4-6-13(16)7-5-12/h4-7,11,14-15H,8-10H2,1-3H3/t14-,15?/m0/s1
InChIKeyCGTPLXCDWDGDPI-MLCCFXAWSA-N
MW251.80 g/mol
LogP4.03
Rot. Bonds2

About (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine

(4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine (PubChem CID 70966986) has the molecular formula C15H22ClN and a molecular weight of 251.80 g/mol. Its IUPAC name is (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine.

Molecular Properties

Compound Name(4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine
PubChem CID70966986
Molecular FormulaC15H22ClN
Molecular Weight251.80 g/mol
Exact Mass251.14
IUPAC Name(4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine
SMILESCC(C)C1CN(C)CC[C@H]1c1ccc(Cl)cc1
InChIInChI=1S/C15H22ClN/c1-11(2)15-10-17(3)9-8-14(15)12-4-6-13(16)7-5-12/h4-7,11,14-15H,8-10H2,1-3H3/t14-,15?/m0/s1
InChIKeyCGTPLXCDWDGDPI-MLCCFXAWSA-N
XLogP4.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.80
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(3R,4S)-4-(4-chlorophenyl)-1-methylpiperidine-3-carboxylic acid
CID 10824789
[(3R,4R)-4-(4-chlorophenyl)-1-methylpiperidin-3-yl] methyl carbonate
CID 68807567
(3R)-3-(4-chloro-3-fluorophenyl)-1-methyl-4-propan-2-ylpyrrolidine
CID 138667866
[4-(4-chlorophenyl)-1-methylpiperidin-3-yl]methyl acetate
CID 22649568
2-[(3R,4S)-4-(4-chlorophenyl)-1-methylpiperidin-3-yl]-N,N-dimethylacetamide
CID 11471946
2-[[(3S,4S)-4-(4-chlorophenyl)-1-methylpiperidin-3-yl]methylsulfanyl]ethanol
CID 11594586
N-[(1S)-1-(4-chlorophenyl)ethyl]-1-methylpyrrolidin-3-amine
CID 81352092
2-[[(3R,4S)-4-(4-chlorophenyl)-1-methylpiperidin-3-yl]methylsulfanyl]-N-methylacetamide
CID 11301852
5-[(3R,4S)-4-(4-chlorophenyl)-1-methylpiperidine-3-carbonyl]oxypentyl (3R,4S)-4-(4-chlorophenyl)-1-methylpiperidine-3-carboxylate
CID 10076847
(3R,4R)-4-(4-chlorophenyl)-1-methylpyrrolidin-3-amine
CID 124669561
3-[(4-chlorophenoxy)methyl]-1-methyl-4-phenylpiperidine
CID 23196644
1,4-dimethyl-3-propan-2-ylpiperidine
CID 139491712

Frequently Asked Questions

What is the IUPAC name of (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine?
The IUPAC name of (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine (CID 70966986) is (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine.
What is the SMILES notation for (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine?
The canonical SMILES for (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine is CC(C)C1CN(C)CC[C@H]1c1ccc(Cl)cc1.
What is the InChIKey of (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine?
The InChIKey is CGTPLXCDWDGDPI-MLCCFXAWSA-N. The full InChI is InChI=1S/C15H22ClN/c1-11(2)15-10-17(3)9-8-14(15)12-4-6-13(16)7-5-12/h4-7,11,14-15H,8-10H2,1-3H3/t14-,15?/m0/s1.
What are the key properties of (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine?
(4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine has a molecular weight of 251.80 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-(4-chlorophenyl)-1-methyl-3-propan-2-ylpiperidine is sourced from PubChem (CID 70966986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).