6-pyridin-3-ylpyrimidine-2,4-diamine

C9H9N5 — CID 90189944

IUPAC6-pyridin-3-ylpyrimidine-2,4-diamine
SMILESNc1cc(-c2cccnc2)nc(N)n1
InChIInChI=1S/C9H9N5/c10-8-4-7(13-9(11)14-8)6-2-1-3-12-5-6/h1-5H,(H4,10,11,13,14)
InChIKeyQYNMHZZGXGZZJG-UHFFFAOYSA-N
MW187.21 g/mol
LogP0.70
Rot. Bonds1

About 6-pyridin-3-ylpyrimidine-2,4-diamine

6-pyridin-3-ylpyrimidine-2,4-diamine (PubChem CID 90189944) has the molecular formula C9H9N5 and a molecular weight of 187.21 g/mol. Its IUPAC name is 6-pyridin-3-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-pyridin-3-ylpyrimidine-2,4-diamine
PubChem CID90189944
Molecular FormulaC9H9N5
Molecular Weight187.21 g/mol
Exact Mass187.09
IUPAC Name6-pyridin-3-ylpyrimidine-2,4-diamine
SMILESNc1cc(-c2cccnc2)nc(N)n1
InChIInChI=1S/C9H9N5/c10-8-4-7(13-9(11)14-8)6-2-1-3-12-5-6/h1-5H,(H4,10,11,13,14)
InChIKeyQYNMHZZGXGZZJG-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

4-[2-(4-aminophenyl)-6-pyridin-3-ylpyrimidin-4-yl]aniline
CID 630923
4-(3-chloro-4-methoxyphenyl)-6-pyridin-3-ylpyrimidin-2-amine
CID 58626083
2,4-diphenyl-6-pyridin-3-ylpyridine
CID 3477432
2,6-dipyridin-3-ylpyridine
CID 13349632
2-[3,5-bis[6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]phenyl]-6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyridine
CID 58090487
5-pyridin-3-yl-1H-pyrazol-3-amine;hydrochloride
CID 47002499
4-chloro-2-(4-propan-2-yloxyphenyl)-6-pyridin-3-ylpyridine
CID 90118273
tetrakis(6-pyridin-3-ylpyrazin-2-yl)silane
CID 71124249
4,6-bis(3,5-dipyridin-3-ylphenyl)-2-pyridin-3-ylpyrimidine
CID 102345540
4-(3,5-dipyridin-3-ylphenyl)-2,6-diphenylpyridine
CID 58518535
4-methyl-6-pyridin-3-yl-1,3,5-triazin-2-amine
CID 14045777
5-(2-pyridin-3-yl-4-pyridinyl)pyrazin-2-amine
CID 174562607

Frequently Asked Questions

What is the IUPAC name of 6-pyridin-3-ylpyrimidine-2,4-diamine?
The IUPAC name of 6-pyridin-3-ylpyrimidine-2,4-diamine (CID 90189944) is 6-pyridin-3-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-pyridin-3-ylpyrimidine-2,4-diamine?
The canonical SMILES for 6-pyridin-3-ylpyrimidine-2,4-diamine is Nc1cc(-c2cccnc2)nc(N)n1.
What is the InChIKey of 6-pyridin-3-ylpyrimidine-2,4-diamine?
The InChIKey is QYNMHZZGXGZZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5/c10-8-4-7(13-9(11)14-8)6-2-1-3-12-5-6/h1-5H,(H4,10,11,13,14).
What are the key properties of 6-pyridin-3-ylpyrimidine-2,4-diamine?
6-pyridin-3-ylpyrimidine-2,4-diamine 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 6-pyridin-3-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 90189944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).