2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid

C11H15N3O2 — CID 83838240

IUPAC2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid
SMILESCc1nc2c(c(N(C)CC(=O)O)n1)CCC2
InChIInChI=1S/C11H15N3O2/c1-7-12-9-5-3-4-8(9)11(13-7)14(2)6-10(15)16/h3-6H2,1-2H3,(H,15,16)
InChIKeyYLFMXZIKISSNCL-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.79
Rot. Bonds3

About 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid

2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid (PubChem CID 83838240) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid.

Molecular Properties

Compound Name2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid
PubChem CID83838240
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid
SMILESCc1nc2c(c(N(C)CC(=O)O)n1)CCC2
InChIInChI=1S/C11H15N3O2/c1-7-12-9-5-3-4-8(9)11(13-7)14(2)6-10(15)16/h3-6H2,1-2H3,(H,15,16)
InChIKeyYLFMXZIKISSNCL-UHFFFAOYSA-N
XLogP0.79
TPSA66.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid?
The IUPAC name of 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid (CID 83838240) is 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid.
What is the SMILES notation for 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid?
The canonical SMILES for 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid is Cc1nc2c(c(N(C)CC(=O)O)n1)CCC2.
What is the InChIKey of 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid?
The InChIKey is YLFMXZIKISSNCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7-12-9-5-3-4-8(9)11(13-7)14(2)6-10(15)16/h3-6H2,1-2H3,(H,15,16).
What are the key properties of 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid?
2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid has a molecular weight of 221.26 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-(2-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)amino]acetic acid is sourced from PubChem (CID 83838240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).