2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid

C11H20N2O3 — CID 64812288

IUPAC2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid
SMILESCC(N)CCC(=O)NC1CCCC1C(=O)O
InChIInChI=1S/C11H20N2O3/c1-7(12)5-6-10(14)13-9-4-2-3-8(9)11(15)16/h7-9H,2-6,12H2,1H3,(H,13,14)(H,15,16)
InChIKeyGISSAYVUGSDZBQ-UHFFFAOYSA-N
MW228.29 g/mol
LogP0.48
Rot. Bonds5

About 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid

2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid (PubChem CID 64812288) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid
PubChem CID64812288
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid
SMILESCC(N)CCC(=O)NC1CCCC1C(=O)O
InChIInChI=1S/C11H20N2O3/c1-7(12)5-6-10(14)13-9-4-2-3-8(9)11(15)16/h7-9H,2-6,12H2,1H3,(H,13,14)(H,15,16)
InChIKeyGISSAYVUGSDZBQ-UHFFFAOYSA-N
XLogP0.48
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-aminohexanoylamino)cyclopentane-1-carboxylic acid
CID 82851867
4-amino-N-[(1S,2S)-2-hydroxycyclohexyl]pentanamide
CID 107221714
2-[[4-(2-aminoethyl)-5-methylhexanoyl]amino]cyclohexane-1-carboxylic acid
CID 64816609
2-(4-aminobutanoylamino)cyclopentane-1-carboxylic acid
CID 64814362
2-(3-methoxypropanoylamino)cyclopentane-1-carboxylic acid
CID 64813718
2-[4-(methylamino)butanoylamino]cyclopentane-1-carboxylic acid
CID 64814365
4-(4-aminopentanoylamino)-2,2,3-trimethylcyclohexane-1-carboxylic acid
CID 102629437
4-amino-N-(2-benzylcyclopentyl)pentanamide;hydrochloride
CID 120563001
2-[[(2S,3S)-2-amino-3-methylpentanoyl]amino]cyclopentane-1-carboxylic acid
CID 64812508
2-[[2-[1-(methylamino)cyclohexyl]acetyl]amino]cyclopentane-1-carboxylic acid
CID 65241761
N-(2-carbamothioylcyclopentyl)-4-methoxypentanamide
CID 113382161
2-[(2-methoxyacetyl)amino]cyclopentane-1-carboxylic acid
CID 64814951

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid (CID 64812288) is 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid is CC(N)CCC(=O)NC1CCCC1C(=O)O.
What is the InChIKey of 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid?
The InChIKey is GISSAYVUGSDZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-7(12)5-6-10(14)13-9-4-2-3-8(9)11(15)16/h7-9H,2-6,12H2,1H3,(H,13,14)(H,15,16).
What are the key properties of 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid?
2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid has a molecular weight of 228.29 g/mol, XLogP of 0.48, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopentanoylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 64812288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).