(3R)-1-methyl-3-pentylpiperidine

C11H23N — CID 143571155

IUPAC(3R)-1-methyl-3-pentylpiperidine
SMILESCCCCC[C@@H]1CCCN(C)C1
InChIInChI=1S/C11H23N/c1-3-4-5-7-11-8-6-9-12(2)10-11/h11H,3-10H2,1-2H3/t11-/m1/s1
InChIKeyBDACIRNLSMRPTQ-LLVKDONJSA-N
MW169.31 g/mol
LogP2.91
Rot. Bonds4

About (3R)-1-methyl-3-pentylpiperidine

(3R)-1-methyl-3-pentylpiperidine (PubChem CID 143571155) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is (3R)-1-methyl-3-pentylpiperidine.

Molecular Properties

Compound Name(3R)-1-methyl-3-pentylpiperidine
PubChem CID143571155
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name(3R)-1-methyl-3-pentylpiperidine
SMILESCCCCC[C@@H]1CCCN(C)C1
InChIInChI=1S/C11H23N/c1-3-4-5-7-11-8-6-9-12(2)10-11/h11H,3-10H2,1-2H3/t11-/m1/s1
InChIKeyBDACIRNLSMRPTQ-LLVKDONJSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-butyl-1-methylpiperidine;hydrofluoride
CID 175875067
methylcyclohexane;1-methyl-3-pentylpiperidine
CID 143571089
4-(1-methylpiperidin-3-yl)butan-1-ol
CID 70064070
1,3-di(tridecyl)piperidine
CID 162511834
3-butyl-1-dodecylpiperidine
CID 171569666
3-butyl-1-decylpiperidine;hydrochloride
CID 175874858
3-butyl-1-pentylpiperidine;formonitrile
CID 175874905
1-methyl-3-[4-(1-methylpiperidin-4-yl)hexyl]piperidine
CID 91610130
ethane;3-ethyl-1-methylpiperidine
CID 142833851
(2S)-2-[(3-pentylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 143571311
1-buta-1,3-dien-2-yl-3-pentylpiperidine
CID 135219142
3-(1-methylpiperidin-3-yl)propanal
CID 83905184

Frequently Asked Questions

What is the IUPAC name of (3R)-1-methyl-3-pentylpiperidine?
The IUPAC name of (3R)-1-methyl-3-pentylpiperidine (CID 143571155) is (3R)-1-methyl-3-pentylpiperidine.
What is the SMILES notation for (3R)-1-methyl-3-pentylpiperidine?
The canonical SMILES for (3R)-1-methyl-3-pentylpiperidine is CCCCC[C@@H]1CCCN(C)C1.
What is the InChIKey of (3R)-1-methyl-3-pentylpiperidine?
The InChIKey is BDACIRNLSMRPTQ-LLVKDONJSA-N. The full InChI is InChI=1S/C11H23N/c1-3-4-5-7-11-8-6-9-12(2)10-11/h11H,3-10H2,1-2H3/t11-/m1/s1.
What are the key properties of (3R)-1-methyl-3-pentylpiperidine?
(3R)-1-methyl-3-pentylpiperidine has a molecular weight of 169.31 g/mol, XLogP of 2.91, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-methyl-3-pentylpiperidine is sourced from PubChem (CID 143571155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).