2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid

C11H15N3O2 — CID 60838829

IUPAC2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid
SMILESO=C(O)CN(c1cnccn1)C1CCCC1
InChIInChI=1S/C11H15N3O2/c15-11(16)8-14(9-3-1-2-4-9)10-7-12-5-6-13-10/h5-7,9H,1-4,8H2,(H,15,16)
InChIKeyZXUMWWBOURUPRS-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.31
Rot. Bonds4

About 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid

2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid (PubChem CID 60838829) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid
PubChem CID60838829
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid
SMILESO=C(O)CN(c1cnccn1)C1CCCC1
InChIInChI=1S/C11H15N3O2/c15-11(16)8-14(9-3-1-2-4-9)10-7-12-5-6-13-10/h5-7,9H,1-4,8H2,(H,15,16)
InChIKeyZXUMWWBOURUPRS-UHFFFAOYSA-N
XLogP1.31
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid
CID 60838156
2-[cyclopentyl(pyridin-3-yl)amino]acetic acid
CID 83822381
2-[cyclopropyl(pyridin-2-yl)amino]acetic acid
CID 82372467
2-[cyclopropyl-(5,6-dimethylpyrazin-2-yl)amino]acetic acid
CID 114474311
N'-cyclopropyl-N'-pyrazin-2-ylpropane-1,3-diamine
CID 43137158
2-[cyclopropyl-[(1S)-1-pyrazin-2-ylethyl]amino]acetic acid
CID 96555431
2-[cyclopropyl-(2-cyclopropylpyrimidin-4-yl)amino]acetic acid
CID 83841041
2-[(3-bromo-4-pyridinyl)-cyclopentylamino]acetamide
CID 104778295
4-N-ethyl-4-N-pyrazin-2-ylcyclohexane-1,4-diamine
CID 79111979
2-[cyclopropyl(pyridazin-3-yl)amino]acetic acid
CID 82239338
2-[cyclopropyl-(3,5-dimethyl-4-pyridinyl)amino]acetic acid
CID 83837701
2-[cyclopentyl(thieno[2,3-d]pyrimidin-4-yl)amino]acetic acid
CID 60840198

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid?
The IUPAC name of 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid (CID 60838829) is 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid is O=C(O)CN(c1cnccn1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid?
The InChIKey is ZXUMWWBOURUPRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c15-11(16)8-14(9-3-1-2-4-9)10-7-12-5-6-13-10/h5-7,9H,1-4,8H2,(H,15,16).
What are the key properties of 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid?
2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid has a molecular weight of 221.26 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl(pyrazin-2-yl)amino]acetic acid is sourced from PubChem (CID 60838829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).