1-(1-piperidin-1-ylcyclopentyl)nonan-1-one

C19H35NO — CID 79059235

IUPAC1-(1-piperidin-1-ylcyclopentyl)nonan-1-one
SMILESCCCCCCCCC(=O)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C19H35NO/c1-2-3-4-5-6-8-13-18(21)19(14-9-10-15-19)20-16-11-7-12-17-20/h2-17H2,1H3
InChIKeyAVOLKLCMNNLCNE-UHFFFAOYSA-N
MW293.50 g/mol
LogP5.10
Rot. Bonds9

About 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one

1-(1-piperidin-1-ylcyclopentyl)nonan-1-one (PubChem CID 79059235) has the molecular formula C19H35NO and a molecular weight of 293.50 g/mol. Its IUPAC name is 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one.

Molecular Properties

Compound Name1-(1-piperidin-1-ylcyclopentyl)nonan-1-one
PubChem CID79059235
Molecular FormulaC19H35NO
Molecular Weight293.50 g/mol
Exact Mass293.27
IUPAC Name1-(1-piperidin-1-ylcyclopentyl)nonan-1-one
SMILESCCCCCCCCC(=O)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C19H35NO/c1-2-3-4-5-6-8-13-18(21)19(14-9-10-15-19)20-16-11-7-12-17-20/h2-17H2,1H3
InChIKeyAVOLKLCMNNLCNE-UHFFFAOYSA-N
XLogP5.10
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.50
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(1-piperidin-1-ylcyclopentyl)butan-1-one
CID 79059234
4-methylsulfonyl-1-(1-pyrrolidin-1-ylcyclopentyl)butan-1-one
CID 79060746
1-(1-hydroxycyclohexyl)tridecan-1-one
CID 103449729
3-ethyl-1-(1-pyrrolidin-1-ylcyclopentyl)heptan-1-one
CID 79058691
1-(1-ethylcyclopentyl)heptan-1-one
CID 114966682
1-[1-(aminomethyl)cyclohexyl]decan-1-one
CID 116600522
1-(1-aminocyclobutyl)octan-1-one
CID 116598372
(4-methylcyclohexyl)-(1-piperidin-1-ylcyclopentyl)methanone
CID 79057458
1-(3-methylpiperidin-3-yl)heptan-1-one
CID 116569464
cyclohexane;octanoyl chloride
CID 175478267
1-pyrrolidin-1-ylheptadecan-1-one
CID 574649
1-(1-aminocyclopropyl)tridecan-1-one
CID 116576674

Frequently Asked Questions

What is the IUPAC name of 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one?
The IUPAC name of 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one (CID 79059235) is 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one.
What is the SMILES notation for 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one?
The canonical SMILES for 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one is CCCCCCCCC(=O)C1(N2CCCCC2)CCCC1.
What is the InChIKey of 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one?
The InChIKey is AVOLKLCMNNLCNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35NO/c1-2-3-4-5-6-8-13-18(21)19(14-9-10-15-19)20-16-11-7-12-17-20/h2-17H2,1H3.
What are the key properties of 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one?
1-(1-piperidin-1-ylcyclopentyl)nonan-1-one has a molecular weight of 293.50 g/mol, XLogP of 5.10, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-piperidin-1-ylcyclopentyl)nonan-1-one is sourced from PubChem (CID 79059235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).