4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine

C14H20ClNO — CID 117387972

IUPAC4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine
SMILESCCc1cc(Cl)cc(C2CCNCC2)c1OC
InChIInChI=1S/C14H20ClNO/c1-3-10-8-12(15)9-13(14(10)17-2)11-4-6-16-7-5-11/h8-9,11,16H,3-7H2,1-2H3
InChIKeyLVDCCNHYOHPXRC-UHFFFAOYSA-N
MW253.77 g/mol
LogP3.38
Rot. Bonds3

About 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine

4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine (PubChem CID 117387972) has the molecular formula C14H20ClNO and a molecular weight of 253.77 g/mol. Its IUPAC name is 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine.

Molecular Properties

Compound Name4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine
PubChem CID117387972
Molecular FormulaC14H20ClNO
Molecular Weight253.77 g/mol
Exact Mass253.12
IUPAC Name4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine
SMILESCCc1cc(Cl)cc(C2CCNCC2)c1OC
InChIInChI=1S/C14H20ClNO/c1-3-10-8-12(15)9-13(14(10)17-2)11-4-6-16-7-5-11/h8-9,11,16H,3-7H2,1-2H3
InChIKeyLVDCCNHYOHPXRC-UHFFFAOYSA-N
XLogP3.38
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.77
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine 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

4-(3-chloro-2-ethyl-4,5-dimethoxyphenyl)piperidine
CID 117456299
4-(3-chloro-2,4,5-trimethoxyphenyl)piperidine
CID 117460328
1-[(5-chloro-3-ethyl-2-methoxyphenyl)methyl]piperazine
CID 117425714
3-(5-chloro-3-fluoro-2-methoxyphenyl)pyrrolidine
CID 117331486
1-[2-(5-chloro-3-ethyl-2-methoxyphenyl)ethyl]piperazine
CID 117454705
1,5-dichloro-3-ethyl-2-methoxybenzene
CID 71215672
4-(4-chloro-2,3-dimethoxyphenyl)piperidine
CID 117392507
4-(2,3-dimethoxy-4,5-dimethylphenyl)piperidine
CID 117377304
3-(5-chloro-2-ethyl-4-methoxyphenyl)pyrrolidine
CID 84701649
4-[2-methoxy-3-(methoxymethyl)phenyl]piperidine
CID 117343038
4-(3-fluoro-2-methoxy-5-propan-2-ylphenyl)piperidine
CID 117382003
(5-chloro-3-ethyl-2-methoxyphenyl)phosphane
CID 142101436

Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine?
The IUPAC name of 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine (CID 117387972) is 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine.
What is the SMILES notation for 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine?
The canonical SMILES for 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine is CCc1cc(Cl)cc(C2CCNCC2)c1OC.
What is the InChIKey of 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine?
The InChIKey is LVDCCNHYOHPXRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20ClNO/c1-3-10-8-12(15)9-13(14(10)17-2)11-4-6-16-7-5-11/h8-9,11,16H,3-7H2,1-2H3.
What are the key properties of 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine?
4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine has a molecular weight of 253.77 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-3-ethyl-2-methoxyphenyl)piperidine is sourced from PubChem (CID 117387972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).