1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine

C15H20N4 — CID 107504530

IUPAC1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine
SMILESCCC(N)Cc1ccnc(-c2cc(C)nc(C)c2)n1
InChIInChI=1S/C15H20N4/c1-4-13(16)9-14-5-6-17-15(19-14)12-7-10(2)18-11(3)8-12/h5-8,13H,4,9,16H2,1-3H3
InChIKeyQMWIDHNSMOYLRL-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.44
Rot. Bonds4

About 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine

1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine (PubChem CID 107504530) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine.

Molecular Properties

Compound Name1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine
PubChem CID107504530
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine
SMILESCCC(N)Cc1ccnc(-c2cc(C)nc(C)c2)n1
InChIInChI=1S/C15H20N4/c1-4-13(16)9-14-5-6-17-15(19-14)12-7-10(2)18-11(3)8-12/h5-8,13H,4,9,16H2,1-3H3
InChIKeyQMWIDHNSMOYLRL-UHFFFAOYSA-N
XLogP2.44
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(2-methylpyrimidin-4-yl)pyrimidin-4-yl]butan-2-amine
CID 115531276
1-[2-(3-bromo-4-methoxyphenyl)pyrimidin-4-yl]butan-2-amine
CID 106951252
1-(6-methyl-2-pyridin-4-ylpyrimidin-4-yl)butan-2-amine
CID 62746111
1-(2-pyrimidin-4-ylpyrimidin-4-yl)butan-2-amine
CID 63987310
1-[2-(6-methoxypyrimidin-4-yl)pyrimidin-4-yl]butan-2-amine
CID 102952915
1-(2-butan-2-ylpyrimidin-4-yl)butan-2-amine
CID 63717252
1-[2-(2-methylpropyl)pyrimidin-4-yl]butan-2-amine
CID 62744170
1-[2-(propan-2-ylsulfanylmethyl)pyrimidin-4-yl]butan-2-amine
CID 65133488
1-[2-(3-bromo-4-methylphenyl)-6-methylpyrimidin-4-yl]butan-2-amine
CID 107915616
1-[2-(3,5-dimethoxyphenyl)pyrimidin-4-yl]propan-2-amine
CID 103399718
1-[2-(3-bromo-4-chlorophenyl)-6-methylpyrimidin-4-yl]butan-2-amine
CID 115568456
1-(2-pyrrolidin-1-ylpyrimidin-4-yl)butan-2-amine
CID 62745750

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine?
The IUPAC name of 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine (CID 107504530) is 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine.
What is the SMILES notation for 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine?
The canonical SMILES for 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine is CCC(N)Cc1ccnc(-c2cc(C)nc(C)c2)n1.
What is the InChIKey of 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine?
The InChIKey is QMWIDHNSMOYLRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-4-13(16)9-14-5-6-17-15(19-14)12-7-10(2)18-11(3)8-12/h5-8,13H,4,9,16H2,1-3H3.
What are the key properties of 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine?
1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,6-dimethyl-4-pyridinyl)pyrimidin-4-yl]butan-2-amine is sourced from PubChem (CID 107504530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).