(2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid

C10H17NO3 — CID 175738929

IUPAC(2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid
SMILESCCC[C@H](NC1CCCC1=O)C(=O)O
InChIInChI=1S/C10H17NO3/c1-2-4-8(10(13)14)11-7-5-3-6-9(7)12/h7-8,11H,2-6H2,1H3,(H,13,14)/t7?,8-/m0/s1
InChIKeyPPYBVRBRDIZDKF-MQWKRIRWSA-N
MW199.25 g/mol
LogP0.95
Rot. Bonds5

About (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid

(2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid (PubChem CID 175738929) has the molecular formula C10H17NO3 and a molecular weight of 199.25 g/mol. Its IUPAC name is (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid.

Molecular Properties

Compound Name(2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid
PubChem CID175738929
Molecular FormulaC10H17NO3
Molecular Weight199.25 g/mol
Exact Mass199.12
IUPAC Name(2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid
SMILESCCC[C@H](NC1CCCC1=O)C(=O)O
InChIInChI=1S/C10H17NO3/c1-2-4-8(10(13)14)11-7-5-3-6-9(7)12/h7-8,11H,2-6H2,1H3,(H,13,14)/t7?,8-/m0/s1
InChIKeyPPYBVRBRDIZDKF-MQWKRIRWSA-N
XLogP0.95
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.25
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)pentanoic acid
CID 65054889
2-[(1-methyl-6-oxopiperidin-3-yl)amino]pentanoic acid
CID 83042057
(2S)-2-[[(3S,8aR)-1-(carboxymethyl)-2-oxo-3,4,5,5a,6,7,8,8a-octahydrocyclopenta[b]azepin-3-yl]amino]pentanoic acid
CID 18634390
2-[(4-fluoro-2,3-dihydro-1H-inden-1-yl)amino]pentanoic acid
CID 83069027
(2S)-2-acetamido-3-(2-oxocyclopentyl)propanoic acid
CID 69083438
2-[(1-methyl-2-oxopyrrolidin-3-yl)amino]hexanoic acid
CID 106257611
2-(oxolan-3-ylamino)pentanoic acid
CID 63557369
2-(1-azabicyclo[2.2.2]octan-3-ylamino)pentanoic acid
CID 65055562
(2R)-2-[[(2R,6S)-2,6-dimethylpiperidine-1-carbonyl]amino]pentanoic acid
CID 107567758
2-[(4-cyclopentylphenyl)methylamino]pentanoic acid
CID 122039745
2-[(1-cyclopropylpyrrolidin-3-yl)amino]pentanoic acid
CID 65055653
2-(cyclohexylamino)heptanoic acid
CID 60998800

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid?
The IUPAC name of (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid (CID 175738929) is (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid.
What is the SMILES notation for (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid?
The canonical SMILES for (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid is CCC[C@H](NC1CCCC1=O)C(=O)O.
What is the InChIKey of (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid?
The InChIKey is PPYBVRBRDIZDKF-MQWKRIRWSA-N. The full InChI is InChI=1S/C10H17NO3/c1-2-4-8(10(13)14)11-7-5-3-6-9(7)12/h7-8,11H,2-6H2,1H3,(H,13,14)/t7?,8-/m0/s1.
What are the key properties of (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid?
(2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid has a molecular weight of 199.25 g/mol, XLogP of 0.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2-oxocyclopentyl)amino]pentanoic acid is sourced from PubChem (CID 175738929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).