6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine

C12H14N6 — CID 110254331

IUPAC6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
SMILESNc1cc(N2CCCC2c2cnccn2)ncn1
InChIInChI=1S/C12H14N6/c13-11-6-12(17-8-16-11)18-5-1-2-10(18)9-7-14-3-4-15-9/h3-4,6-8,10H,1-2,5H2,(H2,13,16,17)
InChIKeyHBDRSCDNYUOKNY-UHFFFAOYSA-N
MW242.29 g/mol
LogP1.19
Rot. Bonds2

About 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine

6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine (PubChem CID 110254331) has the molecular formula C12H14N6 and a molecular weight of 242.29 g/mol. Its IUPAC name is 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
PubChem CID110254331
Molecular FormulaC12H14N6
Molecular Weight242.29 g/mol
Exact Mass242.13
IUPAC Name6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine
SMILESNc1cc(N2CCCC2c2cnccn2)ncn1
InChIInChI=1S/C12H14N6/c13-11-6-12(17-8-16-11)18-5-1-2-10(18)9-7-14-3-4-15-9/h3-4,6-8,10H,1-2,5H2,(H2,13,16,17)
InChIKeyHBDRSCDNYUOKNY-UHFFFAOYSA-N
XLogP1.19
TPSA80.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-Butylpteridine-2,4-diamine
CID 119091307
1-Ethyl-3-[6-[4-[3-(prop-2-ynylamino)propyl]imidazol-1-yl]pyrimidin-4-yl]thiourea
CID 145951519
1-Ethyl-3-[6-[4-[3-[methyl(prop-2-ynyl)amino]propyl]imidazol-1-yl]pyrimidin-4-yl]thiourea
CID 145959317
6-[4-(4-cyclopropyl-1H-1,2,3-triazol-1-yl)piperidin-1-yl]-N-isopropylpyrimidin-4-amine
CID 46995038
6-[4-(4-cyclopentyltriazol-1-yl)piperidin-1-yl]-N-propan-2-ylpyrimidin-4-amine
CID 46998993
2-methyl-N-(1-methyl-2-pyrazin-2-ylethyl)-5-propylpyrimidin-4-amine
CID 50951797
N~4~,N~4~,5-trimethyl-N~2~-(1-methyl-2-pyrazin-2-ylethyl)pyrimidine-2,4-diamine
CID 50951856
6-methyl-N-(1-methyl-2-pyrazin-2-ylethyl)-2-propylpyrimidin-4-amine
CID 50965065
4,6-dimethyl-N-(1-methyl-2-pyrazin-2-ylethyl)pyrimidin-2-amine
CID 50967182
N,N,6-trimethyl-2-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]pyrimidin-4-amine
CID 53565265
N-methyl-6-[2-[[(5-methylpyrazin-2-yl)methylamino]methyl]pyrrolidin-1-yl]pyrimidin-4-amine
CID 71933042
4-Methyl-6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidine
CID 73439388

Frequently Asked Questions

What is the IUPAC name of 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine?
The IUPAC name of 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine (CID 110254331) is 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine?
The canonical SMILES for 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine is Nc1cc(N2CCCC2c2cnccn2)ncn1.
What is the InChIKey of 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine?
The InChIKey is HBDRSCDNYUOKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N6/c13-11-6-12(17-8-16-11)18-5-1-2-10(18)9-7-14-3-4-15-9/h3-4,6-8,10H,1-2,5H2,(H2,13,16,17).
What are the key properties of 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine?
6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine has a molecular weight of 242.29 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-pyrazin-2-ylpyrrolidin-1-yl)pyrimidin-4-amine is sourced from PubChem (CID 110254331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).