N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine

C17H24N4 — CID 63839957

IUPACN-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine
SMILESCc1ccnc(-c2nc(C)c(CNCC(C)C)c(C)n2)c1
InChIInChI=1S/C17H24N4/c1-11(2)9-18-10-15-13(4)20-17(21-14(15)5)16-8-12(3)6-7-19-16/h6-8,11,18H,9-10H2,1-5H3
InChIKeySTJNLUHZRJACIL-UHFFFAOYSA-N
MW284.41 g/mol
LogP3.21
Rot. Bonds5

About N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine

N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine (PubChem CID 63839957) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine
PubChem CID63839957
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC NameN-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine
SMILESCc1ccnc(-c2nc(C)c(CNCC(C)C)c(C)n2)c1
InChIInChI=1S/C17H24N4/c1-11(2)9-18-10-15-13(4)20-17(21-14(15)5)16-8-12(3)6-7-19-16/h6-8,11,18H,9-10H2,1-5H3
InChIKeySTJNLUHZRJACIL-UHFFFAOYSA-N
XLogP3.21
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]propan-1-amine
CID 63839795
N-[[2-(5-fluoro-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]methyl]-2-methylpropan-1-amine
CID 79712935
3-[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]-2-methylpropan-1-amine
CID 65293667
4-[4,6-dimethyl-5-[(2-methylpropylamino)methyl]pyrimidin-2-yl]phenol
CID 136889475
N-[[4,6-dimethyl-2-(pyridin-4-ylmethyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine
CID 62746547
N-[2-(4,6-dimethyl-2-pyrazin-2-ylpyrimidin-5-yl)ethyl]-2-methylpropan-1-amine
CID 62744430
N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]ethanamine
CID 62744443
N-[(2-tert-butyl-4,6-dimethylpyrimidin-5-yl)methyl]-2-methylpropan-1-amine
CID 62746709
N-[[2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]propan-2-amine
CID 63839132
2-methyl-N-[(6-methyl-2-pyrazin-2-ylpyrimidin-4-yl)methyl]propan-1-amine
CID 55114573
N-[[2-(azepan-1-yl)-4,6-dimethylpyrimidin-5-yl]methyl]-2-methylpropan-1-amine
CID 62746715
1-(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)-N-methylmethanamine
CID 62745820

Frequently Asked Questions

What is the IUPAC name of N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine?
The IUPAC name of N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine (CID 63839957) is N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine is Cc1ccnc(-c2nc(C)c(CNCC(C)C)c(C)n2)c1.
What is the InChIKey of N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine?
The InChIKey is STJNLUHZRJACIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-11(2)9-18-10-15-13(4)20-17(21-14(15)5)16-8-12(3)6-7-19-16/h6-8,11,18H,9-10H2,1-5H3.
What are the key properties of N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine?
N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine has a molecular weight of 284.41 g/mol, XLogP of 3.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4,6-dimethyl-2-(4-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]-2-methylpropan-1-amine is sourced from PubChem (CID 63839957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).