propan-2-yl 2-(cyclopentanecarbonylamino)acetate

C11H19NO3 — CID 56808767

IUPACpropan-2-yl 2-(cyclopentanecarbonylamino)acetate
SMILESCC(C)OC(=O)CNC(=O)C1CCCC1
InChIInChI=1S/C11H19NO3/c1-8(2)15-10(13)7-12-11(14)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,12,14)
InChIKeyLJKZEYVSTMPGMO-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.24
Rot. Bonds4

About propan-2-yl 2-(cyclopentanecarbonylamino)acetate

propan-2-yl 2-(cyclopentanecarbonylamino)acetate (PubChem CID 56808767) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is propan-2-yl 2-(cyclopentanecarbonylamino)acetate.

Molecular Properties

Compound Namepropan-2-yl 2-(cyclopentanecarbonylamino)acetate
PubChem CID56808767
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Namepropan-2-yl 2-(cyclopentanecarbonylamino)acetate
SMILESCC(C)OC(=O)CNC(=O)C1CCCC1
InChIInChI=1S/C11H19NO3/c1-8(2)15-10(13)7-12-11(14)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,12,14)
InChIKeyLJKZEYVSTMPGMO-UHFFFAOYSA-N
XLogP1.24
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

propan-2-yl 2-[(4-butylcyclohexanecarbonyl)amino]acetate
CID 56551069
tert-butyl 2-(cyclopentanecarbonylamino)acetate
CID 123696523
N-(3-methyl-2-oxobutyl)cyclobutanecarboxamide
CID 64996921
N-(2-oxopropyl)cycloheptanecarboxamide
CID 64996887
[(1S)-1-cyclopropylethyl] 3-(cyclobutanecarbonylamino)propanoate
CID 95572913
N-(2-methylprop-2-enyl)cyclopentanecarboxamide
CID 91695769
N-(2-chloropropyl)cyclopentanecarboxamide
CID 114296250
N-(2-methylpropyl)cyclooctanecarboxamide
CID 65022959
[(1S)-1,2-bis(4-methylphenyl)-2-oxoethyl] 2-(cyclohexanecarbonylamino)acetate
CID 7783066
ethyl 2-(cyclopropanecarbonylamino)acetate
CID 5228151
N-[2-(dimethylamino)-2-oxoethyl]cyclopentanecarboxamide
CID 39969864
propan-2-yl (2S)-2-(cyclohexanecarbonylamino)propanoate
CID 94867461

Frequently Asked Questions

What is the IUPAC name of propan-2-yl 2-(cyclopentanecarbonylamino)acetate?
The IUPAC name of propan-2-yl 2-(cyclopentanecarbonylamino)acetate (CID 56808767) is propan-2-yl 2-(cyclopentanecarbonylamino)acetate.
What is the SMILES notation for propan-2-yl 2-(cyclopentanecarbonylamino)acetate?
The canonical SMILES for propan-2-yl 2-(cyclopentanecarbonylamino)acetate is CC(C)OC(=O)CNC(=O)C1CCCC1.
What is the InChIKey of propan-2-yl 2-(cyclopentanecarbonylamino)acetate?
The InChIKey is LJKZEYVSTMPGMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-8(2)15-10(13)7-12-11(14)9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H,12,14).
What are the key properties of propan-2-yl 2-(cyclopentanecarbonylamino)acetate?
propan-2-yl 2-(cyclopentanecarbonylamino)acetate has a molecular weight of 213.28 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl 2-(cyclopentanecarbonylamino)acetate is sourced from PubChem (CID 56808767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).