2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid

C15H26N2O3 — CID 62691355

IUPAC2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid
SMILESCCN(C(=O)N1CCCC(CC(=O)O)C1)C1CCCC1
InChIInChI=1S/C15H26N2O3/c1-2-17(13-7-3-4-8-13)15(20)16-9-5-6-12(11-16)10-14(18)19/h12-13H,2-11H2,1H3,(H,18,19)
InChIKeyNVUDUEZUNDJZNI-UHFFFAOYSA-N
MW282.38 g/mol
LogP2.56
Rot. Bonds4

About 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid

2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid (PubChem CID 62691355) has the molecular formula C15H26N2O3 and a molecular weight of 282.38 g/mol. Its IUPAC name is 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid
PubChem CID62691355
Molecular FormulaC15H26N2O3
Molecular Weight282.38 g/mol
Exact Mass282.19
IUPAC Name2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid
SMILESCCN(C(=O)N1CCCC(CC(=O)O)C1)C1CCCC1
InChIInChI=1S/C15H26N2O3/c1-2-17(13-7-3-4-8-13)15(20)16-9-5-6-12(11-16)10-14(18)19/h12-13H,2-11H2,1H3,(H,18,19)
InChIKeyNVUDUEZUNDJZNI-UHFFFAOYSA-N
XLogP2.56
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[cyclohexyl(ethyl)carbamoyl]azetidin-3-yl]acetic acid
CID 64618408
2-[cyclopentyl-(3-ethylpiperidine-1-carbonyl)amino]acetic acid
CID 61200673
2-[1-[ethyl(propan-2-yl)carbamoyl]piperidin-3-yl]acetic acid
CID 62689121
2-[4-[cyclohexyl(ethyl)carbamoyl]morpholin-2-yl]acetic acid
CID 66433858
2-[1-(pentan-2-ylcarbamoyl)piperidin-3-yl]acetic acid
CID 62690824
N-(4-aminocyclohexyl)-N-ethyl-3-methylpiperidine-1-carboxamide
CID 79162664
2-[1-(4-propan-2-ylpiperidine-1-carbonyl)piperidin-3-yl]acetic acid
CID 103500361
2-[1-[methyl(2-pyrrolidin-1-ylethyl)carbamoyl]piperidin-3-yl]acetic acid
CID 63209312
2-[1-[[2-(ethylamino)-2-oxoethyl]-methylcarbamoyl]piperidin-3-yl]acetic acid
CID 62676642
2-[1-(2-ethylbutanoyl)piperidin-3-yl]acetic acid
CID 55105089
N,3-diethyl-N-methylpiperidine-1-carboxamide
CID 116654344
2-[1-(cycloheptanecarbonyl)piperidin-3-yl]acetic acid
CID 62691115

Frequently Asked Questions

What is the IUPAC name of 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid?
The IUPAC name of 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid (CID 62691355) is 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid.
What is the SMILES notation for 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid?
The canonical SMILES for 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid is CCN(C(=O)N1CCCC(CC(=O)O)C1)C1CCCC1.
What is the InChIKey of 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid?
The InChIKey is NVUDUEZUNDJZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O3/c1-2-17(13-7-3-4-8-13)15(20)16-9-5-6-12(11-16)10-14(18)19/h12-13H,2-11H2,1H3,(H,18,19).
What are the key properties of 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid?
2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid has a molecular weight of 282.38 g/mol, XLogP of 2.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[cyclopentyl(ethyl)carbamoyl]piperidin-3-yl]acetic acid is sourced from PubChem (CID 62691355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).