4-(1-methylpiperidin-3-yl)butan-1-ol

C10H21NO — CID 70064070

IUPAC4-(1-methylpiperidin-3-yl)butan-1-ol
SMILESCN1CCCC(CCCCO)C1
InChIInChI=1S/C10H21NO/c1-11-7-4-6-10(9-11)5-2-3-8-12/h10,12H,2-9H2,1H3
InChIKeyGORZFBPSNCQJDH-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds4

About 4-(1-methylpiperidin-3-yl)butan-1-ol

4-(1-methylpiperidin-3-yl)butan-1-ol (PubChem CID 70064070) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 4-(1-methylpiperidin-3-yl)butan-1-ol.

Molecular Properties

Compound Name4-(1-methylpiperidin-3-yl)butan-1-ol
PubChem CID70064070
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name4-(1-methylpiperidin-3-yl)butan-1-ol
SMILESCN1CCCC(CCCCO)C1
InChIInChI=1S/C10H21NO/c1-11-7-4-6-10(9-11)5-2-3-8-12/h10,12H,2-9H2,1H3
InChIKeyGORZFBPSNCQJDH-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3R)-1-methyl-3-pentylpiperidine
CID 143571155
3-butyl-1-methylpiperidine;hydrofluoride
CID 175875067
ethane;(1-methylpiperidin-3-yl)methanol
CID 142013659
methylcyclohexane;1-methyl-3-pentylpiperidine
CID 143571089
[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]methanol
CID 115229573
8-cyclopentyloctan-1-ol
CID 19083491
4-cycloheptylbutan-1-ol
CID 54439965
6-[4-(1-methylpiperidin-3-yl)piperazin-1-yl]hexan-1-ol
CID 71861093
3-(1-methylpiperidin-3-yl)propanal
CID 83905184
3-but-3-enyl-1-methylpiperidine
CID 55275631
4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol
CID 63764428
11-cyclohexylundecan-1-ol
CID 18980516

Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpiperidin-3-yl)butan-1-ol?
The IUPAC name of 4-(1-methylpiperidin-3-yl)butan-1-ol (CID 70064070) is 4-(1-methylpiperidin-3-yl)butan-1-ol.
What is the SMILES notation for 4-(1-methylpiperidin-3-yl)butan-1-ol?
The canonical SMILES for 4-(1-methylpiperidin-3-yl)butan-1-ol is CN1CCCC(CCCCO)C1.
What is the InChIKey of 4-(1-methylpiperidin-3-yl)butan-1-ol?
The InChIKey is GORZFBPSNCQJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-11-7-4-6-10(9-11)5-2-3-8-12/h10,12H,2-9H2,1H3.
What are the key properties of 4-(1-methylpiperidin-3-yl)butan-1-ol?
4-(1-methylpiperidin-3-yl)butan-1-ol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpiperidin-3-yl)butan-1-ol is sourced from PubChem (CID 70064070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).