1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one

C14H25NO3 — CID 79545002

IUPAC1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one
SMILESCOCCC(=O)N1CCCCC1C1CCCC1O
InChIInChI=1S/C14H25NO3/c1-18-10-8-14(17)15-9-3-2-6-12(15)11-5-4-7-13(11)16/h11-13,16H,2-10H2,1H3
InChIKeyDZAZMYADPCREBV-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.57
Rot. Bonds4

About 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one

1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one (PubChem CID 79545002) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one.

Molecular Properties

Compound Name1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one
PubChem CID79545002
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC Name1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one
SMILESCOCCC(=O)N1CCCCC1C1CCCC1O
InChIInChI=1S/C14H25NO3/c1-18-10-8-14(17)15-9-3-2-6-12(15)11-5-4-7-13(11)16/h11-13,16H,2-10H2,1H3
InChIKeyDZAZMYADPCREBV-UHFFFAOYSA-N
XLogP1.57
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-hydroxycyclohexyl)piperidin-1-yl]butan-1-one
CID 79553643
3-ethoxy-1-[2-(2-hydroxycyclohexyl)pyrrolidin-1-yl]propan-1-one
CID 79546527
1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-2-propan-2-yloxyethanone
CID 112603247
2-ethoxy-1-[2-(2-hydroxycyclopentyl)pyrrolidin-1-yl]ethanone
CID 79544158
1-[2-(2-hydroxycyclohexyl)pyrrolidin-1-yl]octan-1-one
CID 79539770
3-methoxy-1-[(2R)-2-[(2R)-1-methylpyrrolidin-2-yl]pyrrolidin-1-yl]propan-1-one
CID 98758074
methyl 2-(2-hydroxycyclopentyl)pyrrolidine-1-carboxylate
CID 79544161
N,N-diethyl-2-(2-hydroxycyclopentyl)piperidine-1-carboxamide
CID 79545752
N-ethyl-2-(2-hydroxycyclopentyl)piperidine-1-carboxamide
CID 79545828
cyclohexyl-[2-(2-hydroxycyclopentyl)piperidin-1-yl]methanone
CID 79545603
1-[(2R)-2-[(1S,2R)-2-hydroxycyclohexyl]pyrrolidin-1-yl]-2-(4-methoxyphenyl)ethanone
CID 129480992
1-[(2R)-2-[(1R,2R)-2-hydroxycyclohexyl]pyrrolidin-1-yl]-2-(2,2,2-trifluoroethoxy)ethanone
CID 129447529

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one?
The IUPAC name of 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one (CID 79545002) is 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one.
What is the SMILES notation for 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one?
The canonical SMILES for 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one is COCCC(=O)N1CCCCC1C1CCCC1O.
What is the InChIKey of 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one?
The InChIKey is DZAZMYADPCREBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-18-10-8-14(17)15-9-3-2-6-12(15)11-5-4-7-13(11)16/h11-13,16H,2-10H2,1H3.
What are the key properties of 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one?
1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one has a molecular weight of 255.36 g/mol, XLogP of 1.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-hydroxycyclopentyl)piperidin-1-yl]-3-methoxypropan-1-one is sourced from PubChem (CID 79545002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).