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

C9H11N3O2 — CID 60838156

IUPAC2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid
SMILESO=C(O)CN(c1cnccn1)C1CC1
InChIInChI=1S/C9H11N3O2/c13-9(14)6-12(7-1-2-7)8-5-10-3-4-11-8/h3-5,7H,1-2,6H2,(H,13,14)
InChIKeyBZDZXOVMLWDUDM-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.53
Rot. Bonds4

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

2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid (PubChem CID 60838156) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid
PubChem CID60838156
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid
SMILESO=C(O)CN(c1cnccn1)C1CC1
InChIInChI=1S/C9H11N3O2/c13-9(14)6-12(7-1-2-7)8-5-10-3-4-11-8/h3-5,7H,1-2,6H2,(H,13,14)
InChIKeyBZDZXOVMLWDUDM-UHFFFAOYSA-N
XLogP0.53
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid?
The IUPAC name of 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid (CID 60838156) is 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid.
What is the SMILES notation for 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid?
The canonical SMILES for 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid is O=C(O)CN(c1cnccn1)C1CC1.
What is the InChIKey of 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid?
The InChIKey is BZDZXOVMLWDUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c13-9(14)6-12(7-1-2-7)8-5-10-3-4-11-8/h3-5,7H,1-2,6H2,(H,13,14).
What are the key properties of 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid?
2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid has a molecular weight of 193.21 g/mol, XLogP of 0.53, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopropyl(pyrazin-2-yl)amino]acetic acid is sourced from PubChem (CID 60838156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).