4-(6-amino-3-pyridinyl)pyrimidin-2-amine

C9H9N5 — CID 130204719

IUPAC4-(6-amino-3-pyridinyl)pyrimidin-2-amine
SMILESNc1ccc(-c2ccnc(N)n2)cn1
InChIInChI=1S/C9H9N5/c10-8-2-1-6(5-13-8)7-3-4-12-9(11)14-7/h1-5H,(H2,10,13)(H2,11,12,14)
InChIKeyFTBPXILSARLRBQ-UHFFFAOYSA-N
MW187.21 g/mol
LogP0.70
Rot. Bonds1

About 4-(6-amino-3-pyridinyl)pyrimidin-2-amine

4-(6-amino-3-pyridinyl)pyrimidin-2-amine (PubChem CID 130204719) has the molecular formula C9H9N5 and a molecular weight of 187.21 g/mol. Its IUPAC name is 4-(6-amino-3-pyridinyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-(6-amino-3-pyridinyl)pyrimidin-2-amine
PubChem CID130204719
Molecular FormulaC9H9N5
Molecular Weight187.21 g/mol
Exact Mass187.09
IUPAC Name4-(6-amino-3-pyridinyl)pyrimidin-2-amine
SMILESNc1ccc(-c2ccnc(N)n2)cn1
InChIInChI=1S/C9H9N5/c10-8-2-1-6(5-13-8)7-3-4-12-9(11)14-7/h1-5H,(H2,10,13)(H2,11,12,14)
InChIKeyFTBPXILSARLRBQ-UHFFFAOYSA-N
XLogP0.70
TPSA90.71 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.21
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Amprolium Hydrochloride
CID 8732
Quinazoline
CID 9210
4-Aminoquinazoline
CID 84759
2-(Benzylamino)pyridine
CID 23362
2,2'-Dipyridylamine
CID 14547
Amprolium
CID 73341
Msx-122
CID 11687907
4-Phenylpyrimidine
CID 18923
6-Aminoquinazoline
CID 589288
4-[(E)-2-phenylethenyl]pyrimidin-2-amine
CID 46911068
2-Amino-4-phenylpyrimidine
CID 598777
WZ 811
CID 11565518

Frequently Asked Questions

What is the IUPAC name of 4-(6-amino-3-pyridinyl)pyrimidin-2-amine?
The IUPAC name of 4-(6-amino-3-pyridinyl)pyrimidin-2-amine (CID 130204719) is 4-(6-amino-3-pyridinyl)pyrimidin-2-amine.
What is the SMILES notation for 4-(6-amino-3-pyridinyl)pyrimidin-2-amine?
The canonical SMILES for 4-(6-amino-3-pyridinyl)pyrimidin-2-amine is Nc1ccc(-c2ccnc(N)n2)cn1.
What is the InChIKey of 4-(6-amino-3-pyridinyl)pyrimidin-2-amine?
The InChIKey is FTBPXILSARLRBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5/c10-8-2-1-6(5-13-8)7-3-4-12-9(11)14-7/h1-5H,(H2,10,13)(H2,11,12,14).
What are the key properties of 4-(6-amino-3-pyridinyl)pyrimidin-2-amine?
4-(6-amino-3-pyridinyl)pyrimidin-2-amine has a molecular weight of 187.21 g/mol, XLogP of 0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-amino-3-pyridinyl)pyrimidin-2-amine is sourced from PubChem (CID 130204719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).