2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid

C14H24N2O3 — CID 55125772

IUPAC2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid
SMILESCN(CC1CCC1)C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C14H24N2O3/c1-15(9-11-5-4-6-11)14(19)16(10-13(17)18)12-7-2-3-8-12/h11-12H,2-10H2,1H3,(H,17,18)
InChIKeyUSACKDKTQMNRAG-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.17
Rot. Bonds5

About 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid

2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid (PubChem CID 55125772) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid.

Molecular Properties

Compound Name2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid
PubChem CID55125772
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid
SMILESCN(CC1CCC1)C(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C14H24N2O3/c1-15(9-11-5-4-6-11)14(19)16(10-13(17)18)12-7-2-3-8-12/h11-12H,2-10H2,1H3,(H,17,18)
InChIKeyUSACKDKTQMNRAG-UHFFFAOYSA-N
XLogP2.17
TPSA60.85 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[cyclopentylmethyl(methyl)carbamoyl]-methylamino]acetic acid
CID 63656971
2-[cyclopentyl-[methyl(oxan-2-ylmethyl)carbamoyl]amino]acetic acid
CID 61435932
2-[[cyclopentylmethyl(methyl)carbamoyl]-ethylamino]acetic acid
CID 63655952
2-[[cyclohexylmethyl(methyl)carbamoyl]-ethylamino]acetic acid
CID 61444099
2-[cyclopentyl-[methyl(2,2,2-trifluoroethyl)carbamoyl]amino]acetic acid
CID 61203827
cycloheptylmethyl(methyl)carbamic acid
CID 146255648
2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid
CID 61342644
2-[cyclopentyl-[methyl(3-methylbutan-2-yl)carbamoyl]amino]acetic acid
CID 61202141
2-[(2-cyclohexylacetyl)-cyclopentylamino]acetic acid
CID 60826296
4-[cyclopentylmethyl(methyl)amino]-4-oxobutanoic acid
CID 63632290
2-[cycloheptyl(methyl)amino]acetic acid
CID 43409736
2-[cyclopentyl-[methyl(phenyl)carbamoyl]amino]acetic acid
CID 61186503

Frequently Asked Questions

What is the IUPAC name of 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid?
The IUPAC name of 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid (CID 55125772) is 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid.
What is the SMILES notation for 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid?
The canonical SMILES for 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid is CN(CC1CCC1)C(=O)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid?
The InChIKey is USACKDKTQMNRAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-15(9-11-5-4-6-11)14(19)16(10-13(17)18)12-7-2-3-8-12/h11-12H,2-10H2,1H3,(H,17,18).
What are the key properties of 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid?
2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid has a molecular weight of 268.36 g/mol, XLogP of 2.17, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[cyclobutylmethyl(methyl)carbamoyl]-cyclopentylamino]acetic acid is sourced from PubChem (CID 55125772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).