2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid

C12H19NO3 — CID 79849092

IUPAC2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid
SMILESO=C(O)CC1(NC(=O)C2CCCC2)CCC1
InChIInChI=1S/C12H19NO3/c14-10(15)8-12(6-3-7-12)13-11(16)9-4-1-2-5-9/h9H,1-8H2,(H,13,16)(H,14,15)
InChIKeyBQOOJCXDPNWFCK-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.69
Rot. Bonds4

About 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid

2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid (PubChem CID 79849092) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid.

Molecular Properties

Compound Name2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid
PubChem CID79849092
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid
SMILESO=C(O)CC1(NC(=O)C2CCCC2)CCC1
InChIInChI=1S/C12H19NO3/c14-10(15)8-12(6-3-7-12)13-11(16)9-4-1-2-5-9/h9H,1-8H2,(H,13,16)(H,14,15)
InChIKeyBQOOJCXDPNWFCK-UHFFFAOYSA-N
XLogP1.69
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(cyclooctanecarbonylamino)cyclohexyl]acetic acid
CID 65019610
N-[1-(hydroxymethyl)cyclobutyl]cycloheptanecarboxamide
CID 115878103
2-[1-[(3-fluorocyclohexanecarbonyl)amino]cyclobutyl]acetic acid
CID 122129354
2-[1-[[(3S)-piperidine-3-carbonyl]amino]cyclobutyl]acetic acid
CID 81133872
N-[1-(hydroxymethyl)cyclobutyl]cyclopropanecarboxamide
CID 115878461
N-[1-(hydroxymethyl)cyclopropyl]cycloheptanecarboxamide
CID 115764905
2-[1-[(5-oxopyrrolidine-3-carbonyl)amino]cyclobutyl]acetic acid
CID 83191868
2-[1-[(2-cyclopentylsulfonylacetyl)amino]cyclobutyl]acetic acid
CID 119217995
2-[1-[[1-(cyclopropanecarbonyl)piperidine-3-carbonyl]amino]cyclopropyl]acetic acid
CID 167826404
2-[1-[[(2R)-piperidine-2-carbonyl]amino]cyclohexyl]acetic acid
CID 104914061
2-[1-(cyclobutylcarbamoylamino)cyclobutyl]acetic acid
CID 79851699
1-(cyclopentanecarbonylamino)cyclobutane-1-carboxylic acid
CID 81158706

Frequently Asked Questions

What is the IUPAC name of 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid?
The IUPAC name of 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid (CID 79849092) is 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid.
What is the SMILES notation for 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid?
The canonical SMILES for 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid is O=C(O)CC1(NC(=O)C2CCCC2)CCC1.
What is the InChIKey of 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid?
The InChIKey is BQOOJCXDPNWFCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c14-10(15)8-12(6-3-7-12)13-11(16)9-4-1-2-5-9/h9H,1-8H2,(H,13,16)(H,14,15).
What are the key properties of 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid?
2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid has a molecular weight of 225.29 g/mol, XLogP of 1.69, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(cyclopentanecarbonylamino)cyclobutyl]acetic acid is sourced from PubChem (CID 79849092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).