(2E)-2-[(4-chlorophenyl)methylidene]piperidine

C12H14ClN — CID 142714481

IUPAC(2E)-2-[(4-chlorophenyl)methylidene]piperidine
SMILESClc1ccc(/C=C2\CCCCN2)cc1
InChIInChI=1S/C12H14ClN/c13-11-6-4-10(5-7-11)9-12-3-1-2-8-14-12/h4-7,9,14H,1-3,8H2/b12-9+
InChIKeyCQSAMGXJXLVTDH-FMIVXFBMSA-N
MW207.70 g/mol
LogP3.45
Rot. Bonds1

About (2E)-2-[(4-chlorophenyl)methylidene]piperidine

(2E)-2-[(4-chlorophenyl)methylidene]piperidine (PubChem CID 142714481) has the molecular formula C12H14ClN and a molecular weight of 207.70 g/mol. Its IUPAC name is (2E)-2-[(4-chlorophenyl)methylidene]piperidine.

Molecular Properties

Compound Name(2E)-2-[(4-chlorophenyl)methylidene]piperidine
PubChem CID142714481
Molecular FormulaC12H14ClN
Molecular Weight207.70 g/mol
Exact Mass207.08
IUPAC Name(2E)-2-[(4-chlorophenyl)methylidene]piperidine
SMILESClc1ccc(/C=C2\CCCCN2)cc1
InChIInChI=1S/C12H14ClN/c13-11-6-4-10(5-7-11)9-12-3-1-2-8-14-12/h4-7,9,14H,1-3,8H2/b12-9+
InChIKeyCQSAMGXJXLVTDH-FMIVXFBMSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.70
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (2E)-2-[(4-chlorophenyl)methylidene]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

3-[(4-chlorophenyl)methylidene]azetidine
CID 79879268
2-[(4-chlorophenyl)methylidene]cycloheptane-1,3-dione
CID 86059583
2-[(Z)-piperidin-2-ylidenemethyl]pyridine
CID 19922854
(2Z)-2-[(4-chlorophenyl)methylidene]cyclohexan-1-one
CID 6450877
(2E)-2-[(4-chlorophenyl)methylidene]cyclooctan-1-one
CID 12682640
2-[(1-methylpyrazol-3-yl)methylidene]piperidine
CID 141119282
(NZ)-N-[2-[(4-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine
CID 5464792
(2E)-2,5-bis[(4-chlorophenyl)methylidene]cyclopentan-1-one
CID 694487
(3E)-1-[(4-chlorophenyl)methyl]-3-[(4-chlorophenyl)methylidene]pyrrolidine
CID 177393308
2-[4-(azetidin-3-ylidenemethyl)phenyl]-1-(4-chlorophenyl)ethanone
CID 147181912
(2Z)-2-(azepan-2-ylidene)acetaldehyde
CID 55298697
2-piperidin-2-ylideneethanol
CID 67807310

Frequently Asked Questions

What is the IUPAC name of (2E)-2-[(4-chlorophenyl)methylidene]piperidine?
The IUPAC name of (2E)-2-[(4-chlorophenyl)methylidene]piperidine (CID 142714481) is (2E)-2-[(4-chlorophenyl)methylidene]piperidine.
What is the SMILES notation for (2E)-2-[(4-chlorophenyl)methylidene]piperidine?
The canonical SMILES for (2E)-2-[(4-chlorophenyl)methylidene]piperidine is Clc1ccc(/C=C2\CCCCN2)cc1.
What is the InChIKey of (2E)-2-[(4-chlorophenyl)methylidene]piperidine?
The InChIKey is CQSAMGXJXLVTDH-FMIVXFBMSA-N. The full InChI is InChI=1S/C12H14ClN/c13-11-6-4-10(5-7-11)9-12-3-1-2-8-14-12/h4-7,9,14H,1-3,8H2/b12-9+.
What are the key properties of (2E)-2-[(4-chlorophenyl)methylidene]piperidine?
(2E)-2-[(4-chlorophenyl)methylidene]piperidine has a molecular weight of 207.70 g/mol, XLogP of 3.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-2-[(4-chlorophenyl)methylidene]piperidine is sourced from PubChem (CID 142714481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).