2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid

C14H23N3O4 — CID 64669041

IUPAC2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid
SMILESCN1CC(NC(=O)N(CC(=O)O)C2CCCC2)CCC1=O
InChIInChI=1S/C14H23N3O4/c1-16-8-10(6-7-12(16)18)15-14(21)17(9-13(19)20)11-4-2-3-5-11/h10-11H,2-9H2,1H3,(H,15,21)(H,19,20)
InChIKeyFSXGLALFTGYKQH-UHFFFAOYSA-N
MW297.36 g/mol
LogP0.65
Rot. Bonds4

About 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid

2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid (PubChem CID 64669041) has the molecular formula C14H23N3O4 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid
PubChem CID64669041
Molecular FormulaC14H23N3O4
Molecular Weight297.36 g/mol
Exact Mass297.17
IUPAC Name2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid
SMILESCN1CC(NC(=O)N(CC(=O)O)C2CCCC2)CCC1=O
InChIInChI=1S/C14H23N3O4/c1-16-8-10(6-7-12(16)18)15-14(21)17(9-13(19)20)11-4-2-3-5-11/h10-11H,2-9H2,1H3,(H,15,21)(H,19,20)
InChIKeyFSXGLALFTGYKQH-UHFFFAOYSA-N
XLogP0.65
TPSA89.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid?
The IUPAC name of 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid (CID 64669041) is 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid is CN1CC(NC(=O)N(CC(=O)O)C2CCCC2)CCC1=O.
What is the InChIKey of 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid?
The InChIKey is FSXGLALFTGYKQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O4/c1-16-8-10(6-7-12(16)18)15-14(21)17(9-13(19)20)11-4-2-3-5-11/h10-11H,2-9H2,1H3,(H,15,21)(H,19,20).
What are the key properties of 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid?
2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid has a molecular weight of 297.36 g/mol, XLogP of 0.65, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[(1-methyl-6-oxopiperidin-3-yl)carbamoyl]amino]acetic acid is sourced from PubChem (CID 64669041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).