6-methyl-N-propan-2-ylpyrimidin-4-amine

C8H13N3 — CID 61225495

IUPAC6-methyl-N-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(NC(C)C)ncn1
InChIInChI=1S/C8H13N3/c1-6(2)11-8-4-7(3)9-5-10-8/h4-6H,1-3H3,(H,9,10,11)
InChIKeyJLQDHFSLOWUWMH-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.61
Rot. Bonds2

About 6-methyl-N-propan-2-ylpyrimidin-4-amine

6-methyl-N-propan-2-ylpyrimidin-4-amine (PubChem CID 61225495) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 6-methyl-N-propan-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-propan-2-ylpyrimidin-4-amine
PubChem CID61225495
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name6-methyl-N-propan-2-ylpyrimidin-4-amine
SMILESCc1cc(NC(C)C)ncn1
InChIInChI=1S/C8H13N3/c1-6(2)11-8-4-7(3)9-5-10-8/h4-6H,1-3H3,(H,9,10,11)
InChIKeyJLQDHFSLOWUWMH-UHFFFAOYSA-N
XLogP1.61
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-propan-2-ylpyrimidin-4-amine?
The IUPAC name of 6-methyl-N-propan-2-ylpyrimidin-4-amine (CID 61225495) is 6-methyl-N-propan-2-ylpyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-propan-2-ylpyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-propan-2-ylpyrimidin-4-amine is Cc1cc(NC(C)C)ncn1.
What is the InChIKey of 6-methyl-N-propan-2-ylpyrimidin-4-amine?
The InChIKey is JLQDHFSLOWUWMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-6(2)11-8-4-7(3)9-5-10-8/h4-6H,1-3H3,(H,9,10,11).
What are the key properties of 6-methyl-N-propan-2-ylpyrimidin-4-amine?
6-methyl-N-propan-2-ylpyrimidin-4-amine has a molecular weight of 151.21 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-propan-2-ylpyrimidin-4-amine is sourced from PubChem (CID 61225495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).