2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid

C14H24N2O3 — CID 61197071

IUPAC2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid
SMILESO=C(O)CC1CCCCN1C(=O)NCC1CCCC1
InChIInChI=1S/C14H24N2O3/c17-13(18)9-12-7-3-4-8-16(12)14(19)15-10-11-5-1-2-6-11/h11-12H,1-10H2,(H,15,19)(H,17,18)
InChIKeyVZCKYJDVUOCOCX-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.22
Rot. Bonds4

About 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid

2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid (PubChem CID 61197071) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid
PubChem CID61197071
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid
SMILESO=C(O)CC1CCCCN1C(=O)NCC1CCCC1
InChIInChI=1S/C14H24N2O3/c17-13(18)9-12-7-3-4-8-16(12)14(19)15-10-11-5-1-2-6-11/h11-12H,1-10H2,(H,15,19)(H,17,18)
InChIKeyVZCKYJDVUOCOCX-UHFFFAOYSA-N
XLogP2.22
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid?
The IUPAC name of 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid (CID 61197071) is 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid.
What is the SMILES notation for 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid?
The canonical SMILES for 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid is O=C(O)CC1CCCCN1C(=O)NCC1CCCC1.
What is the InChIKey of 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid?
The InChIKey is VZCKYJDVUOCOCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c17-13(18)9-12-7-3-4-8-16(12)14(19)15-10-11-5-1-2-6-11/h11-12H,1-10H2,(H,15,19)(H,17,18).
What are the key properties of 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid?
2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclopentylmethylcarbamoyl)piperidin-2-yl]acetic acid is sourced from PubChem (CID 61197071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).