2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid

C19H28N2O3 — CID 11631338

IUPAC2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid
SMILESCCCC(CC1(C(=O)Nc2cccc(CC)n2)CCCC1)C(=O)O
InChIInChI=1S/C19H28N2O3/c1-3-8-14(17(22)23)13-19(11-5-6-12-19)18(24)21-16-10-7-9-15(4-2)20-16/h7,9-10,14H,3-6,8,11-13H2,1-2H3,(H,22,23)(H,20,21,24)
InChIKeyXQGIVVYXGDZTKU-UHFFFAOYSA-N
MW332.44 g/mol
LogP4.03
Rot. Bonds8

About 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid

2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid (PubChem CID 11631338) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid.

Molecular Properties

Compound Name2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid
PubChem CID11631338
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC Name2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid
SMILESCCCC(CC1(C(=O)Nc2cccc(CC)n2)CCCC1)C(=O)O
InChIInChI=1S/C19H28N2O3/c1-3-8-14(17(22)23)13-19(11-5-6-12-19)18(24)21-16-10-7-9-15(4-2)20-16/h7,9-10,14H,3-6,8,11-13H2,1-2H3,(H,22,23)(H,20,21,24)
InChIKeyXQGIVVYXGDZTKU-UHFFFAOYSA-N
XLogP4.03
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[1-[[(2S)-1-hydroxy-3-phenylpropan-2-yl]carbamoyl]cyclopentyl]methyl]pentanoic acid
CID 11682031
N-(6-fluoro-2-pyridinyl)-1-(2-methylpropyl)cyclopentane-1-carboxamide
CID 113456865
2-[[1-[(5-ethyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclopentyl]methyl]-4-phenylbutanoic acid
CID 11603744
N-(6-ethyl-2-pyridinyl)butanamide
CID 66596264
(2R)-2-[(1-phenylmethoxycarbonylcyclopentyl)methyl]pentanoic acid
CID 59892210
2-[[1-[[5-(cyclopropylmethyl)-1,3,4-thiadiazol-2-yl]carbamoyl]cyclopentyl]methyl]pentanoic acid
CID 11545107
2-[[1-(1,3-benzodioxol-5-ylmethylcarbamoyl)cyclopentyl]methyl]pentanoic acid
CID 11516039
N-(6-bromo-2-pyridinyl)-1-ethylcyclopropane-1-carboxamide
CID 130161849
1-N,3-N,5-N-tris(6-ethyl-2-pyridinyl)benzene-1,3,5-tricarboxamide
CID 11329889
(2R)-2-[[1-[[(2R)-1-carboxy-3-[(4-fluorophenyl)methoxy]propan-2-yl]carbamoyl]cyclopentyl]methyl]pentanoic acid
CID 58633481
2-[[1-[[4-ethoxy-1-[(6-methyl-3-pyridinyl)methoxy]-4-oxobutan-2-yl]carbamoyl]cyclopentyl]methyl]pentanoic acid
CID 22145588
(2R)-2-[[1-[[(2R)-1-[(4-chlorophenyl)methoxy]-4-ethoxy-4-oxobutan-2-yl]carbamoyl]cyclopentyl]methyl]pentanoic acid
CID 58633527

Frequently Asked Questions

What is the IUPAC name of 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
The IUPAC name of 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid (CID 11631338) is 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid.
What is the SMILES notation for 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
The canonical SMILES for 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid is CCCC(CC1(C(=O)Nc2cccc(CC)n2)CCCC1)C(=O)O.
What is the InChIKey of 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
The InChIKey is XQGIVVYXGDZTKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-3-8-14(17(22)23)13-19(11-5-6-12-19)18(24)21-16-10-7-9-15(4-2)20-16/h7,9-10,14H,3-6,8,11-13H2,1-2H3,(H,22,23)(H,20,21,24).
What are the key properties of 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid?
2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid has a molecular weight of 332.44 g/mol, XLogP of 4.03, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-[(6-ethyl-2-pyridinyl)carbamoyl]cyclopentyl]methyl]pentanoic acid is sourced from PubChem (CID 11631338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).