(4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone

C15H28N2O2 — CID 114678344

IUPAC(4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
SMILESCCCC1(C(=O)N2CCC(O)C(C)C2)CCCNC1
InChIInChI=1S/C15H28N2O2/c1-3-6-15(7-4-8-16-11-15)14(19)17-9-5-13(18)12(2)10-17/h12-13,16,18H,3-11H2,1-2H3
InChIKeyQNHIRWHKRAYCEI-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.39
Rot. Bonds3

About (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone

(4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone (PubChem CID 114678344) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name(4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
PubChem CID114678344
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name(4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
SMILESCCCC1(C(=O)N2CCC(O)C(C)C2)CCCNC1
InChIInChI=1S/C15H28N2O2/c1-3-6-15(7-4-8-16-11-15)14(19)17-9-5-13(18)12(2)10-17/h12-13,16,18H,3-11H2,1-2H3
InChIKeyQNHIRWHKRAYCEI-UHFFFAOYSA-N
XLogP1.39
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-hydroxypiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63132180
(3-hydroxypiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63130056
[3-(hydroxymethyl)pyrrolidin-1-yl]-(3-propylpiperidin-3-yl)methanone
CID 112625019
(3,5-dimethylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63132443
8-oxa-3-azabicyclo[3.2.1]octan-3-yl-(3-propylpiperidin-3-yl)methanone
CID 66369459
(1,1-dioxo-1,4-thiazinan-4-yl)-(3-propylpiperidin-3-yl)methanone
CID 55164111
(4-ethylpiperazin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 55177029
(4,4-diethylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 63163762
(4-methylazepan-1-yl)-(3-propylpyrrolidin-3-yl)methanone
CID 63626147
(3-methoxypyrrolidin-1-yl)-(3-propylpyrrolidin-3-yl)methanone
CID 103532913
(3-hydroxy-3-methylpyrrolidin-1-yl)-(3-propylpiperidin-3-yl)methanone
CID 103355905
(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-(3-propylpyrrolidin-3-yl)methanone
CID 79170392

Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone?
The IUPAC name of (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone (CID 114678344) is (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone.
What is the SMILES notation for (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone?
The canonical SMILES for (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone is CCCC1(C(=O)N2CCC(O)C(C)C2)CCCNC1.
What is the InChIKey of (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone?
The InChIKey is QNHIRWHKRAYCEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-6-15(7-4-8-16-11-15)14(19)17-9-5-13(18)12(2)10-17/h12-13,16,18H,3-11H2,1-2H3.
What are the key properties of (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone?
(4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone has a molecular weight of 268.40 g/mol, XLogP of 1.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-3-methylpiperidin-1-yl)-(3-propylpiperidin-3-yl)methanone is sourced from PubChem (CID 114678344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).