4-pyrrolidin-2-ylpyrimidin-2-amine

C8H12N4 — CID 53408029

IUPAC4-pyrrolidin-2-ylpyrimidin-2-amine
SMILESNc1nccc(C2CCCN2)n1
InChIInChI=1S/C8H12N4/c9-8-11-5-3-7(12-8)6-2-1-4-10-6/h3,5-6,10H,1-2,4H2,(H2,9,11,12)
InChIKeyJFWCVNMHIGHJRV-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.48
Rot. Bonds1

About 4-pyrrolidin-2-ylpyrimidin-2-amine

4-pyrrolidin-2-ylpyrimidin-2-amine (PubChem CID 53408029) has the molecular formula C8H12N4 and a molecular weight of 164.21 g/mol. Its IUPAC name is 4-pyrrolidin-2-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-pyrrolidin-2-ylpyrimidin-2-amine
PubChem CID53408029
Molecular FormulaC8H12N4
Molecular Weight164.21 g/mol
Exact Mass164.11
IUPAC Name4-pyrrolidin-2-ylpyrimidin-2-amine
SMILESNc1nccc(C2CCCN2)n1
InChIInChI=1S/C8H12N4/c9-8-11-5-3-7(12-8)6-2-1-4-10-6/h3,5-6,10H,1-2,4H2,(H2,9,11,12)
InChIKeyJFWCVNMHIGHJRV-UHFFFAOYSA-N
XLogP0.48
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2S)-pyrrolidin-2-yl]pyridin-2-amine
CID 55274090
N-pyrimidin-2-yl-4-[(2R)-pyrrolidin-2-yl]pyrimidin-2-amine
CID 95836667
4-methyl-6-[(2S)-pyrrolidin-2-yl]pyrimidin-2-amine
CID 83858445
N-methyl-4-[(2S)-piperidin-2-yl]pyrimidin-2-amine
CID 95827769
2-[(2R)-pyrrolidin-2-yl]pyridine
CID 7141590
2-fluoro-6-[(2R)-pyrrolidin-2-yl]pyridine
CID 131118553
4-(4-pyrrolidin-2-ylpyrimidin-2-yl)morpholine
CID 75485556
N-(4-pyrrolidin-2-ylpyrimidin-2-yl)cyclopropanesulfonamide
CID 167035052
4-fluoro-2-[(2R)-pyrrolidin-2-yl]pyridine
CID 130713831
2-chloro-3-[(2S)-pyrrolidin-2-yl]pyridin-4-amine
CID 131140738
6-[(2R)-pyrrolidin-2-yl]pyridine-2-carbaldehyde
CID 87404647
6-N-methyl-4-N-[4-[(2R)-pyrrolidin-2-yl]pyrimidin-2-yl]pyrimidine-4,6-diamine
CID 95836671

Frequently Asked Questions

What is the IUPAC name of 4-pyrrolidin-2-ylpyrimidin-2-amine?
The IUPAC name of 4-pyrrolidin-2-ylpyrimidin-2-amine (CID 53408029) is 4-pyrrolidin-2-ylpyrimidin-2-amine.
What is the SMILES notation for 4-pyrrolidin-2-ylpyrimidin-2-amine?
The canonical SMILES for 4-pyrrolidin-2-ylpyrimidin-2-amine is Nc1nccc(C2CCCN2)n1.
What is the InChIKey of 4-pyrrolidin-2-ylpyrimidin-2-amine?
The InChIKey is JFWCVNMHIGHJRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4/c9-8-11-5-3-7(12-8)6-2-1-4-10-6/h3,5-6,10H,1-2,4H2,(H2,9,11,12).
What are the key properties of 4-pyrrolidin-2-ylpyrimidin-2-amine?
4-pyrrolidin-2-ylpyrimidin-2-amine has a molecular weight of 164.21 g/mol, XLogP of 0.48, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrrolidin-2-ylpyrimidin-2-amine is sourced from PubChem (CID 53408029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).