3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid

C9H16N2O3 — CID 66009608

IUPAC3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid
SMILESNC1CCC(C(=O)NCCC(=O)O)C1
InChIInChI=1S/C9H16N2O3/c10-7-2-1-6(5-7)9(14)11-4-3-8(12)13/h6-7H,1-5,10H2,(H,11,14)(H,12,13)
InChIKeySUZTUOHVAPSKMM-UHFFFAOYSA-N
MW200.24 g/mol
LogP-0.30
Rot. Bonds4

About 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid

3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid (PubChem CID 66009608) has the molecular formula C9H16N2O3 and a molecular weight of 200.24 g/mol. Its IUPAC name is 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid.

Molecular Properties

Compound Name3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid
PubChem CID66009608
Molecular FormulaC9H16N2O3
Molecular Weight200.24 g/mol
Exact Mass200.12
IUPAC Name3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid
SMILESNC1CCC(C(=O)NCCC(=O)O)C1
InChIInChI=1S/C9H16N2O3/c10-7-2-1-6(5-7)9(14)11-4-3-8(12)13/h6-7H,1-5,10H2,(H,11,14)(H,12,13)
InChIKeySUZTUOHVAPSKMM-UHFFFAOYSA-N
XLogP-0.30
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(3-aminocyclopentanecarbonyl)amino]hexanoic acid
CID 66010231
3-amino-N-(3-amino-3-iminopropyl)cyclopentane-1-carboxamide
CID 10012974
3-amino-N-[3-oxo-3-(propylamino)propyl]cyclopentane-1-carboxamide;hydrochloride
CID 119745932
7-[(3-aminocyclohexanecarbonyl)amino]heptanoic acid
CID 63047132
3-amino-N-(2-cyclopentylethyl)cyclopentane-1-carboxamide
CID 66010406
3-amino-N-[2-(cyclopropanecarbonylamino)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119687746
3-amino-N-hex-5-ynylcyclopentane-1-carboxamide
CID 106212981
3-amino-N-(2-methylsulfinylethyl)cyclopentane-1-carboxamide
CID 115739203
cis-(1R,3S)-3-amino-N-(3-amino-3-iminopropyl)cyclopentane-1-carboxamide;sulfuric acid
CID 3058315
3-amino-N-[2-(azepan-1-yl)ethyl]cyclopentane-1-carboxamide
CID 66008993
3-amino-N-(3-cyanopropyl)cyclopentane-1-carboxamide
CID 66009224
3-amino-N-[2-(2-methoxyethoxy)ethyl]cyclopentane-1-carboxamide
CID 66009424

Frequently Asked Questions

What is the IUPAC name of 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid?
The IUPAC name of 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid (CID 66009608) is 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid.
What is the SMILES notation for 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid?
The canonical SMILES for 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid is NC1CCC(C(=O)NCCC(=O)O)C1.
What is the InChIKey of 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid?
The InChIKey is SUZTUOHVAPSKMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3/c10-7-2-1-6(5-7)9(14)11-4-3-8(12)13/h6-7H,1-5,10H2,(H,11,14)(H,12,13).
What are the key properties of 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid?
3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid has a molecular weight of 200.24 g/mol, XLogP of -0.30, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid is sourced from PubChem (CID 66009608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).