N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine

C15H17N5 — CID 128559417

IUPACN-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine
SMILESc1cnc(-c2ccnc(NC3CC4CCC3C4)n2)cn1
InChIInChI=1S/C15H17N5/c1-2-11-7-10(1)8-13(11)20-15-18-4-3-12(19-15)14-9-16-5-6-17-14/h3-6,9-11,13H,1-2,7-8H2,(H,18,19,20)
InChIKeyYKLIFOTYRZBURQ-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.53
Rot. Bonds3

About N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine

N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine (PubChem CID 128559417) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine
PubChem CID128559417
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC NameN-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine
SMILESc1cnc(-c2ccnc(NC3CC4CCC3C4)n2)cn1
InChIInChI=1S/C15H17N5/c1-2-11-7-10(1)8-13(11)20-15-18-4-3-12(19-15)14-9-16-5-6-17-14/h3-6,9-11,13H,1-2,7-8H2,(H,18,19,20)
InChIKeyYKLIFOTYRZBURQ-UHFFFAOYSA-N
XLogP2.53
TPSA63.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-(oxan-3-yl)-4-pyrazin-2-ylpyrimidin-2-amine
CID 128559210
N-(2-phenylcyclopentyl)-4-pyrazin-2-ylpyrimidin-2-amine
CID 154841280
N-(2-bicyclo[2.2.1]heptanyl)-4-[(3R)-3-(methylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 58227148
N-(2-bicyclo[2.2.1]heptanyl)-3-chloropyridin-4-amine
CID 79839141
N-(3-methylbutan-2-yl)-4-pyrazin-2-ylpyrimidin-2-amine
CID 154841275
N-(2-bicyclo[2.2.1]heptanyl)-4-[3-(4-fluorophenyl)-5-(piperidin-1-ylmethyl)-1,2-oxazol-4-yl]pyrimidin-2-amine
CID 10321399
4-[2-(2-bicyclo[2.2.1]heptanylamino)quinazolin-6-yl]oxy-N-methylpyridine-2-carboxamide
CID 59254869
2-[[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]amino]-4-propan-2-ylpyrimidine-5-carboxylic acid
CID 58168761
N,4-dicyclopropyl-5-pyrazin-2-ylpyrimidin-2-amine
CID 95857494
N-(2-bicyclo[2.2.1]heptanyl)-4,6-dimethoxypyrimidin-2-amine
CID 115355152
N-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]pyridine-3-carboxamide
CID 125073491
4-[(4-pyrazin-2-ylpyrimidin-2-yl)amino]benzoic acid
CID 68850820

Frequently Asked Questions

What is the IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine?
The IUPAC name of N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine (CID 128559417) is N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine.
What is the SMILES notation for N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine?
The canonical SMILES for N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine is c1cnc(-c2ccnc(NC3CC4CCC3C4)n2)cn1.
What is the InChIKey of N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine?
The InChIKey is YKLIFOTYRZBURQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-2-11-7-10(1)8-13(11)20-15-18-4-3-12(19-15)14-9-16-5-6-17-14/h3-6,9-11,13H,1-2,7-8H2,(H,18,19,20).
What are the key properties of N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine?
N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine has a molecular weight of 267.34 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bicyclo[2.2.1]heptanyl)-4-pyrazin-2-ylpyrimidin-2-amine is sourced from PubChem (CID 128559417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).