1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone

C16H30N2O2 — CID 177354667

IUPAC1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(CC2(O)CCN(C(C)C)CC2)CC1
InChIInChI=1S/C16H30N2O2/c1-13(2)17-10-6-16(20,7-11-17)12-15-4-8-18(9-5-15)14(3)19/h13,15,20H,4-12H2,1-3H3
InChIKeySRPKLWMWLWDZPU-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.87
Rot. Bonds3

About 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone

1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone (PubChem CID 177354667) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone
PubChem CID177354667
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(CC2(O)CCN(C(C)C)CC2)CC1
InChIInChI=1S/C16H30N2O2/c1-13(2)17-10-6-16(20,7-11-17)12-15-4-8-18(9-5-15)14(3)19/h13,15,20H,4-12H2,1-3H3
InChIKeySRPKLWMWLWDZPU-UHFFFAOYSA-N
XLogP1.87
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone with MolForge

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Related Compounds

4-propan-2-yl-1-[(1-propan-2-ylpiperidin-4-yl)methyl]cyclohexan-1-ol
CID 170951892
4-(2-cyclopropylethyl)-1-propan-2-ylpiperidin-4-ol
CID 106590391
ethane;1-[4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperazin-1-yl]ethanone
CID 170617031
2-(4-hydroxy-1-propan-2-ylpiperidin-4-yl)acetic acid
CID 62395408
1-[4-(4-propan-2-ylpiperazin-1-yl)piperidin-1-yl]ethanone
CID 156836562
1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone
CID 43223565
ethane;1-[4-fluoro-4-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]-2-methylpropan-1-one
CID 177354793
[4-(cyclopropylmethyl)-1-propan-2-ylpiperidin-4-yl]methanol
CID 58547558
butyl 4-[(1-hydroxycyclopropyl)methyl]piperidine-1-carboxylate
CID 70848394
1-[4-[[(3S)-1-propan-2-ylpyrrolidin-3-yl]methyl]piperazin-1-yl]ethanone
CID 167190623
1-(6-propan-2-yl-2,6-diazaspiro[3.3]heptan-2-yl)-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 177010419
ethane;1-(4-ethylpiperidin-1-yl)-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 176984732

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone (CID 177354667) is 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone is CC(=O)N1CCC(CC2(O)CCN(C(C)C)CC2)CC1.
What is the InChIKey of 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone?
The InChIKey is SRPKLWMWLWDZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-13(2)17-10-6-16(20,7-11-17)12-15-4-8-18(9-5-15)14(3)19/h13,15,20H,4-12H2,1-3H3.
What are the key properties of 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone?
1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone has a molecular weight of 282.43 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl]piperidin-1-yl]ethanone is sourced from PubChem (CID 177354667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).