1-[(3S)-3-methylpent-1-enyl]piperidine

C11H21N — CID 131883569

IUPAC1-[(3S)-3-methylpent-1-enyl]piperidine
SMILESCC[C@H](C)C=CN1CCCCC1
InChIInChI=1S/C11H21N/c1-3-11(2)7-10-12-8-5-4-6-9-12/h7,10-11H,3-6,8-9H2,1-2H3/t11-/m0/s1
InChIKeyNCSQWXTVUQDCRW-NSHDSACASA-N
MW167.30 g/mol
LogP3.03
Rot. Bonds3

About 1-[(3S)-3-methylpent-1-enyl]piperidine

1-[(3S)-3-methylpent-1-enyl]piperidine (PubChem CID 131883569) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is 1-[(3S)-3-methylpent-1-enyl]piperidine.

Molecular Properties

Compound Name1-[(3S)-3-methylpent-1-enyl]piperidine
PubChem CID131883569
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name1-[(3S)-3-methylpent-1-enyl]piperidine
SMILESCC[C@H](C)C=CN1CCCCC1
InChIInChI=1S/C11H21N/c1-3-11(2)7-10-12-8-5-4-6-9-12/h7,10-11H,3-6,8-9H2,1-2H3/t11-/m0/s1
InChIKeyNCSQWXTVUQDCRW-NSHDSACASA-N
XLogP3.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[(3S)-3-methylpent-1-enyl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[(3S)-3-methylpent-1-enyl]piperidine?
The IUPAC name of 1-[(3S)-3-methylpent-1-enyl]piperidine (CID 131883569) is 1-[(3S)-3-methylpent-1-enyl]piperidine.
What is the SMILES notation for 1-[(3S)-3-methylpent-1-enyl]piperidine?
The canonical SMILES for 1-[(3S)-3-methylpent-1-enyl]piperidine is CC[C@H](C)C=CN1CCCCC1.
What is the InChIKey of 1-[(3S)-3-methylpent-1-enyl]piperidine?
The InChIKey is NCSQWXTVUQDCRW-NSHDSACASA-N. The full InChI is InChI=1S/C11H21N/c1-3-11(2)7-10-12-8-5-4-6-9-12/h7,10-11H,3-6,8-9H2,1-2H3/t11-/m0/s1.
What are the key properties of 1-[(3S)-3-methylpent-1-enyl]piperidine?
1-[(3S)-3-methylpent-1-enyl]piperidine has a molecular weight of 167.30 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3S)-3-methylpent-1-enyl]piperidine is sourced from PubChem (CID 131883569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).