cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate

C14H26N2O2 — CID 59453705

IUPACcyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate
SMILESCNC(CC1CCNCC1)C(=O)OC1CCCC1
InChIInChI=1S/C14H26N2O2/c1-15-13(10-11-6-8-16-9-7-11)14(17)18-12-4-2-3-5-12/h11-13,15-16H,2-10H2,1H3
InChIKeyMFYHFVLCLUPXMX-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.45
Rot. Bonds5

About cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate

cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate (PubChem CID 59453705) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate.

Molecular Properties

Compound Namecyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate
PubChem CID59453705
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Namecyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate
SMILESCNC(CC1CCNCC1)C(=O)OC1CCCC1
InChIInChI=1S/C14H26N2O2/c1-15-13(10-11-6-8-16-9-7-11)14(17)18-12-4-2-3-5-12/h11-13,15-16H,2-10H2,1H3
InChIKeyMFYHFVLCLUPXMX-UHFFFAOYSA-N
XLogP1.45
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 171347072
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CID 15697772
CID 15697772
CID 15697773
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CID 75422084
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CID 10313307
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CID 15697774
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CID 13743432
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CID 85665007
CID 85665007

Frequently Asked Questions

What is the IUPAC name of cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate?
The IUPAC name of cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate (CID 59453705) is cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate.
What is the SMILES notation for cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate?
The canonical SMILES for cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate is CNC(CC1CCNCC1)C(=O)OC1CCCC1.
What is the InChIKey of cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate?
The InChIKey is MFYHFVLCLUPXMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-15-13(10-11-6-8-16-9-7-11)14(17)18-12-4-2-3-5-12/h11-13,15-16H,2-10H2,1H3.
What are the key properties of cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate?
cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate has a molecular weight of 254.37 g/mol, XLogP of 1.45, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl 2-(methylamino)-3-piperidin-4-ylpropanoate is sourced from PubChem (CID 59453705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).