3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid

C11H18N2O3 — CID 66031562

IUPAC3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(CNC1CC1)NC1CCC(C(=O)O)C1
InChIInChI=1S/C11H18N2O3/c14-10(6-12-8-3-4-8)13-9-2-1-7(5-9)11(15)16/h7-9,12H,1-6H2,(H,13,14)(H,15,16)
InChIKeyRFVVJFQVIBAVGZ-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.11
Rot. Bonds5

About 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid

3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 66031562) has the molecular formula C11H18N2O3 and a molecular weight of 226.28 g/mol. Its IUPAC name is 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID66031562
Molecular FormulaC11H18N2O3
Molecular Weight226.28 g/mol
Exact Mass226.13
IUPAC Name3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(CNC1CC1)NC1CCC(C(=O)O)C1
InChIInChI=1S/C11H18N2O3/c14-10(6-12-8-3-4-8)13-9-2-1-7(5-9)11(15)16/h7-9,12H,1-6H2,(H,13,14)(H,15,16)
InChIKeyRFVVJFQVIBAVGZ-UHFFFAOYSA-N
XLogP0.11
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

cis-(1R,3S)-3-[(2-cyclopropylacetyl)amino]cyclopentane-1-carboxylic acid
CID 106320836
4-(2-chloroprop-2-enylamino)cyclohexane-1-carboxylic acid
CID 60808095
2-(cyclopentylamino)-N-(3-methylcyclopentyl)acetamide
CID 114546089
4-[[2-(cyclopropylamino)-2-oxoethyl]amino]cyclohexane-1-carboxamide
CID 54914189
3-[(2-cyclopentylacetyl)amino]cyclopentane-1-carboxylic acid
CID 66031106
2-(cyclopropylamino)-N-[2-(cyclopropylamino)-2-oxoethyl]acetamide
CID 60842326
cis-(1S,3R)-3-(4,4,4-trifluorobutanoylamino)cyclopentane-1-carboxylic acid
CID 120676611
3-(4-methylpentanoylamino)cyclopentane-1-carboxylic acid
CID 66030515
4-[[2-(cyclopropylmethylamino)-2-oxoethyl]amino]cyclohexane-1-carboxylic acid
CID 60808097
4-[3-(cyclopropylamino)propanoylamino]cyclohexane-1-carboxylic acid
CID 61161235
N-cyclopropyl-2-[(3,4-dimethylcyclohexyl)amino]acetamide
CID 64732207
3-(hexanoylamino)cyclopentane-1-carboxylic acid
CID 66030150

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid (CID 66031562) is 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid is O=C(CNC1CC1)NC1CCC(C(=O)O)C1.
What is the InChIKey of 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is RFVVJFQVIBAVGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3/c14-10(6-12-8-3-4-8)13-9-2-1-7(5-9)11(15)16/h7-9,12H,1-6H2,(H,13,14)(H,15,16).
What are the key properties of 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid?
3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 226.28 g/mol, XLogP of 0.11, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(cyclopropylamino)acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 66031562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).