1-(1-cycloheptylpiperidin-3-yl)ethanone

C14H25NO — CID 82926630

IUPAC1-(1-cycloheptylpiperidin-3-yl)ethanone
SMILESCC(=O)C1CCCN(C2CCCCCC2)C1
InChIInChI=1S/C14H25NO/c1-12(16)13-7-6-10-15(11-13)14-8-4-2-3-5-9-14/h13-14H,2-11H2,1H3
InChIKeyYVZQKIYVHRQKRM-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.01
Rot. Bonds2

About 1-(1-cycloheptylpiperidin-3-yl)ethanone

1-(1-cycloheptylpiperidin-3-yl)ethanone (PubChem CID 82926630) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-(1-cycloheptylpiperidin-3-yl)ethanone.

Molecular Properties

Compound Name1-(1-cycloheptylpiperidin-3-yl)ethanone
PubChem CID82926630
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name1-(1-cycloheptylpiperidin-3-yl)ethanone
SMILESCC(=O)C1CCCN(C2CCCCCC2)C1
InChIInChI=1S/C14H25NO/c1-12(16)13-7-6-10-15(11-13)14-8-4-2-3-5-9-14/h13-14H,2-11H2,1H3
InChIKeyYVZQKIYVHRQKRM-UHFFFAOYSA-N
XLogP3.01
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 1-cyclopentylpiperidine-3-carboxylate
CID 62025944
N-(1-cycloheptylpiperidin-3-yl)cyclopentanecarboxamide
CID 45199037
1-(1-cyclopentylpiperidin-4-yl)azepane;oxalic acid
CID 17369286
1-[(3S)-1-(cyclopentanecarbonyl)pyrrolidin-3-yl]ethanone
CID 129355291
1-(1-methylsulfonylpiperidin-3-yl)ethanone
CID 59841135
1-azabicyclo[9.1.0]dodecane
CID 87228787
(3R)-1-cyclooctylpiperidin-3-ol
CID 129493857
1-cyclohexylazocane
CID 23151203
1-cyclooctylpyrrolidine
CID 23277874
1-cyclooctylpiperidine
CID 89210756
1-acetyl-4-cyclohexyl-1,4-diazepane-6-carboxamide
CID 110098556
(6S)-1-acetyl-4-cyclohexyl-1,4-diazepane-6-carboxamide
CID 124972494

Frequently Asked Questions

What is the IUPAC name of 1-(1-cycloheptylpiperidin-3-yl)ethanone?
The IUPAC name of 1-(1-cycloheptylpiperidin-3-yl)ethanone (CID 82926630) is 1-(1-cycloheptylpiperidin-3-yl)ethanone.
What is the SMILES notation for 1-(1-cycloheptylpiperidin-3-yl)ethanone?
The canonical SMILES for 1-(1-cycloheptylpiperidin-3-yl)ethanone is CC(=O)C1CCCN(C2CCCCCC2)C1.
What is the InChIKey of 1-(1-cycloheptylpiperidin-3-yl)ethanone?
The InChIKey is YVZQKIYVHRQKRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-12(16)13-7-6-10-15(11-13)14-8-4-2-3-5-9-14/h13-14H,2-11H2,1H3.
What are the key properties of 1-(1-cycloheptylpiperidin-3-yl)ethanone?
1-(1-cycloheptylpiperidin-3-yl)ethanone has a molecular weight of 223.36 g/mol, XLogP of 3.01, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cycloheptylpiperidin-3-yl)ethanone is sourced from PubChem (CID 82926630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).