2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid

C13H24N2O3 — CID 43631930

IUPAC2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid
SMILESCCCC(NC(C)C(=O)NC1CCCC1)C(=O)O
InChIInChI=1S/C13H24N2O3/c1-3-6-11(13(17)18)14-9(2)12(16)15-10-7-4-5-8-10/h9-11,14H,3-8H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyDEXFETPQVZQICN-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.28
Rot. Bonds7

About 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid

2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid (PubChem CID 43631930) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid.

Molecular Properties

Compound Name2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid
PubChem CID43631930
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC Name2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid
SMILESCCCC(NC(C)C(=O)NC1CCCC1)C(=O)O
InChIInChI=1S/C13H24N2O3/c1-3-6-11(13(17)18)14-9(2)12(16)15-10-7-4-5-8-10/h9-11,14H,3-8H2,1-2H3,(H,15,16)(H,17,18)
InChIKeyDEXFETPQVZQICN-UHFFFAOYSA-N
XLogP1.28
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-cycloheptyl-2-methylpentanamide
CID 4532030
(2R)-2-(cyclooctylcarbamoylamino)pentanoic acid
CID 107565953
N-cyclopentyl-2-(3-methylpentan-2-ylamino)propanamide
CID 54950797
ethyl 2-[[1-(cyclohexylamino)-1-oxopropan-2-yl]amino]propanoate
CID 61498920
(2R)-2-[[(2S)-1-(butylamino)-1-oxopropan-2-yl]amino]pentanoic acid
CID 129365438
2-[[1-(methylcarbamoylamino)-1-oxopropan-2-yl]amino]pentanoic acid
CID 43631933
3-(butan-2-ylamino)-N-cyclopentyl-2-oxohexanamide
CID 70287689
(2R)-2-(cyclopropylcarbamoylamino)pentanoic acid
CID 107564781
N-cyclopentyl-2-methylbutanamide;methane
CID 159941857
(2S)-1-[(2S)-2-[[(1S)-1-carboxybutyl]amino]propanoyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid
CID 155075129
2-[2-(cycloheptylamino)-2-oxoethyl]pentanoic acid
CID 112516456
N-cyclopropyl-2-(octan-4-ylamino)propanamide
CID 103728152

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid?
The IUPAC name of 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid (CID 43631930) is 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid.
What is the SMILES notation for 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid?
The canonical SMILES for 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid is CCCC(NC(C)C(=O)NC1CCCC1)C(=O)O.
What is the InChIKey of 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid?
The InChIKey is DEXFETPQVZQICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-3-6-11(13(17)18)14-9(2)12(16)15-10-7-4-5-8-10/h9-11,14H,3-8H2,1-2H3,(H,15,16)(H,17,18).
What are the key properties of 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid?
2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid has a molecular weight of 256.35 g/mol, XLogP of 1.28, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(cyclopentylamino)-1-oxopropan-2-yl]amino]pentanoic acid is sourced from PubChem (CID 43631930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).