2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine

C17H24N6 — CID 110255577

IUPAC2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine
SMILESCc1nc(Nc2cnccn2)cc(C2CCCN(C(C)C)C2)n1
InChIInChI=1S/C17H24N6/c1-12(2)23-8-4-5-14(11-23)15-9-16(21-13(3)20-15)22-17-10-18-6-7-19-17/h6-7,9-10,12,14H,4-5,8,11H2,1-3H3,(H,19,20,21,22)
InChIKeySRFJBNWYWLZGPM-UHFFFAOYSA-N
MW312.42 g/mol
LogP2.91
Rot. Bonds4

About 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine

2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine (PubChem CID 110255577) has the molecular formula C17H24N6 and a molecular weight of 312.42 g/mol. Its IUPAC name is 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine
PubChem CID110255577
Molecular FormulaC17H24N6
Molecular Weight312.42 g/mol
Exact Mass312.21
IUPAC Name2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine
SMILESCc1nc(Nc2cnccn2)cc(C2CCCN(C(C)C)C2)n1
InChIInChI=1S/C17H24N6/c1-12(2)23-8-4-5-14(11-23)15-9-16(21-13(3)20-15)22-17-10-18-6-7-19-17/h6-7,9-10,12,14H,4-5,8,11H2,1-3H3,(H,19,20,21,22)
InChIKeySRFJBNWYWLZGPM-UHFFFAOYSA-N
XLogP2.91
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine?
The IUPAC name of 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine (CID 110255577) is 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine?
The canonical SMILES for 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine is Cc1nc(Nc2cnccn2)cc(C2CCCN(C(C)C)C2)n1.
What is the InChIKey of 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine?
The InChIKey is SRFJBNWYWLZGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6/c1-12(2)23-8-4-5-14(11-23)15-9-16(21-13(3)20-15)22-17-10-18-6-7-19-17/h6-7,9-10,12,14H,4-5,8,11H2,1-3H3,(H,19,20,21,22).
What are the key properties of 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine?
2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine has a molecular weight of 312.42 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(1-propan-2-ylpiperidin-3-yl)-N-pyrazin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 110255577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).