N-pyridin-3-ylpyrimidin-2-amine

C9H8N4 — CID 11593513

IUPACN-pyridin-3-ylpyrimidin-2-amine
SMILESc1cnc(Nc2cccnc2)nc1
InChIInChI=1S/C9H8N4/c1-3-8(7-10-4-1)13-9-11-5-2-6-12-9/h1-7H,(H,11,12,13)
InChIKeyHGIUNFKCNGBMMU-UHFFFAOYSA-N
MW172.19 g/mol
LogP1.62
Rot. Bonds2

About N-pyridin-3-ylpyrimidin-2-amine

N-pyridin-3-ylpyrimidin-2-amine (PubChem CID 11593513) has the molecular formula C9H8N4 and a molecular weight of 172.19 g/mol. Its IUPAC name is N-pyridin-3-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-pyridin-3-ylpyrimidin-2-amine
PubChem CID11593513
Molecular FormulaC9H8N4
Molecular Weight172.19 g/mol
Exact Mass172.07
IUPAC NameN-pyridin-3-ylpyrimidin-2-amine
SMILESc1cnc(Nc2cccnc2)nc1
InChIInChI=1S/C9H8N4/c1-3-8(7-10-4-1)13-9-11-5-2-6-12-9/h1-7H,(H,11,12,13)
InChIKeyHGIUNFKCNGBMMU-UHFFFAOYSA-N
XLogP1.62
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.19
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(pyridin-3-ylamino)pyridine-3-carbonitrile
CID 24708070
(pyridin-3-ylamino)mercury(1+)
CID 16685218
N-fluoropyridin-3-amine
CID 141274626
N-bromopyridin-3-amine
CID 87128938
2-N-pyridin-3-ylpyridine-2,5-diamine
CID 4764177
4-N,6-N-diethyl-2-N-pyridin-3-yl-1,3,5-triazine-2,4,6-triamine
CID 7589444
azane;N-methylpyridin-3-amine
CID 70247108
ethane;N-methylpyridin-3-amine
CID 91430147
N-pyridin-3-ylthiatriazol-5-amine
CID 12638193
ethane;N-(2-methylphenyl)pyridin-3-amine
CID 143449341
N-(3,4-dimethylphenyl)pyridin-3-amine
CID 82537517
N-pyridin-3-ylthiadiazol-5-amine
CID 12638188

Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-ylpyrimidin-2-amine?
The IUPAC name of N-pyridin-3-ylpyrimidin-2-amine (CID 11593513) is N-pyridin-3-ylpyrimidin-2-amine.
What is the SMILES notation for N-pyridin-3-ylpyrimidin-2-amine?
The canonical SMILES for N-pyridin-3-ylpyrimidin-2-amine is c1cnc(Nc2cccnc2)nc1.
What is the InChIKey of N-pyridin-3-ylpyrimidin-2-amine?
The InChIKey is HGIUNFKCNGBMMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N4/c1-3-8(7-10-4-1)13-9-11-5-2-6-12-9/h1-7H,(H,11,12,13).
What are the key properties of N-pyridin-3-ylpyrimidin-2-amine?
N-pyridin-3-ylpyrimidin-2-amine has a molecular weight of 172.19 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-ylpyrimidin-2-amine is sourced from PubChem (CID 11593513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).