[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone

C15H28N2O2 — CID 79536980

IUPAC[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCC(O)CC1CCCCN1C(=O)N1CCC(C)CC1
InChIInChI=1S/C15H28N2O2/c1-12-6-9-16(10-7-12)15(19)17-8-4-3-5-14(17)11-13(2)18/h12-14,18H,3-11H2,1-2H3
InChIKeyFGDODNABSQEDGR-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.46
Rot. Bonds2

About [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone

[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 79536980) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
PubChem CID79536980
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCC(O)CC1CCCCN1C(=O)N1CCC(C)CC1
InChIInChI=1S/C15H28N2O2/c1-12-6-9-16(10-7-12)15(19)17-8-4-3-5-14(17)11-13(2)18/h12-14,18H,3-11H2,1-2H3
InChIKeyFGDODNABSQEDGR-UHFFFAOYSA-N
XLogP2.46
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(2-hydroxypropyl)piperidin-1-yl]-2-methylpropan-1-one
CID 79549260
1-[2-(2-hydroxypropyl)piperidin-1-yl]propan-1-one
CID 79548971
cyclobutyl-[2-(2-hydroxypropyl)pyrrolidin-1-yl]methanone
CID 79546457
N-ethyl-2-(2-hydroxypropyl)-N-methylazepane-1-carboxamide
CID 79559941
1-[2-(2-hydroxypropyl)azepan-1-yl]-4-methylpentan-1-one
CID 79560929
1-[2-(2-hydroxypropyl)piperidin-1-yl]-2-methylsulfonylpropan-1-one
CID 104520556
1-[2-(2-hydroxypropyl)piperidin-1-yl]-2-methylsulfonylethanone
CID 79548822
N-cyclohexyl-2-(2-hydroxypropyl)azepane-1-carboxamide
CID 79560608
1-[2-(2-hydroxypropyl)pyrrolidin-1-yl]propan-1-one
CID 79546453
2-(2-hydroxypropyl)-N,N-dimethylpyrrolidine-1-carboxamide
CID 79547049
N-methyl-1-(4-methylpiperidine-1-carbonyl)piperidine-2-carboxamide
CID 116654881
1-[2-(2-hydroxypropyl)azepan-1-yl]-2-propan-2-yloxyethanone
CID 112603248

Frequently Asked Questions

What is the IUPAC name of [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone (CID 79536980) is [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone is CC(O)CC1CCCCN1C(=O)N1CCC(C)CC1.
What is the InChIKey of [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is FGDODNABSQEDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12-6-9-16(10-7-12)15(19)17-8-4-3-5-14(17)11-13(2)18/h12-14,18H,3-11H2,1-2H3.
What are the key properties of [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone?
[2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 268.40 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-hydroxypropyl)piperidin-1-yl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 79536980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).