N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine

C15H20N6 — CID 95817004

IUPACN,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine
SMILESCc1cc(N(C)C)nc([C@@H]2CCN(c3cnccn3)C2)n1
InChIInChI=1S/C15H20N6/c1-11-8-13(20(2)3)19-15(18-11)12-4-7-21(10-12)14-9-16-5-6-17-14/h5-6,8-9,12H,4,7,10H2,1-3H3/t12-/m1/s1
InChIKeyQAVLNVJLPGNNQE-GFCCVEGCSA-N
MW284.37 g/mol
LogP1.63
Rot. Bonds3

About N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine

N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine (PubChem CID 95817004) has the molecular formula C15H20N6 and a molecular weight of 284.37 g/mol. Its IUPAC name is N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine.

Molecular Properties

Compound NameN,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine
PubChem CID95817004
Molecular FormulaC15H20N6
Molecular Weight284.37 g/mol
Exact Mass284.17
IUPAC NameN,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine
SMILESCc1cc(N(C)C)nc([C@@H]2CCN(c3cnccn3)C2)n1
InChIInChI=1S/C15H20N6/c1-11-8-13(20(2)3)19-15(18-11)12-4-7-21(10-12)14-9-16-5-6-17-14/h5-6,8-9,12H,4,7,10H2,1-3H3/t12-/m1/s1
InChIKeyQAVLNVJLPGNNQE-GFCCVEGCSA-N
XLogP1.63
TPSA58.04 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.37
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine?
The IUPAC name of N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine (CID 95817004) is N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine.
What is the SMILES notation for N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine?
The canonical SMILES for N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine is Cc1cc(N(C)C)nc([C@@H]2CCN(c3cnccn3)C2)n1.
What is the InChIKey of N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine?
The InChIKey is QAVLNVJLPGNNQE-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N6/c1-11-8-13(20(2)3)19-15(18-11)12-4-7-21(10-12)14-9-16-5-6-17-14/h5-6,8-9,12H,4,7,10H2,1-3H3/t12-/m1/s1.
What are the key properties of N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine?
N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine has a molecular weight of 284.37 g/mol, XLogP of 1.63, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,6-trimethyl-2-[(3R)-1-pyrazin-2-ylpyrrolidin-3-yl]pyrimidin-4-amine is sourced from PubChem (CID 95817004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).