methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate

C14H24N2O3 — CID 113330694

IUPACmethyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate
SMILESCOC(=O)CN(C(=O)N1CCCCC1)C1CCCC1
InChIInChI=1S/C14H24N2O3/c1-19-13(17)11-16(12-7-3-4-8-12)14(18)15-9-5-2-6-10-15/h12H,2-11H2,1H3
InChIKeyFHCWBHHFJUGCHI-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.01
Rot. Bonds3

About methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate

methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate (PubChem CID 113330694) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate
PubChem CID113330694
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Namemethyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate
SMILESCOC(=O)CN(C(=O)N1CCCCC1)C1CCCC1
InChIInChI=1S/C14H24N2O3/c1-19-13(17)11-16(12-7-3-4-8-12)14(18)15-9-5-2-6-10-15/h12H,2-11H2,1H3
InChIKeyFHCWBHHFJUGCHI-UHFFFAOYSA-N
XLogP2.01
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate?
The IUPAC name of methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate (CID 113330694) is methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate.
What is the SMILES notation for methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate?
The canonical SMILES for methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate is COC(=O)CN(C(=O)N1CCCCC1)C1CCCC1.
What is the InChIKey of methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate?
The InChIKey is FHCWBHHFJUGCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-19-13(17)11-16(12-7-3-4-8-12)14(18)15-9-5-2-6-10-15/h12H,2-11H2,1H3.
What are the key properties of methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate?
methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate has a molecular weight of 268.36 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[cyclopentyl(piperidine-1-carbonyl)amino]acetate is sourced from PubChem (CID 113330694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).