2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine

C12H19N3 — CID 63353528

IUPAC2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine
SMILESCNc1cc(C2CC2)nc(C(C)(C)C)n1
InChIInChI=1S/C12H19N3/c1-12(2,3)11-14-9(8-5-6-8)7-10(13-4)15-11/h7-8H,5-6H2,1-4H3,(H,13,14,15)
InChIKeyZAGAEUTWYIXEHI-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.69
Rot. Bonds2

About 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine

2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine (PubChem CID 63353528) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine.

Molecular Properties

Compound Name2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine
PubChem CID63353528
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine
SMILESCNc1cc(C2CC2)nc(C(C)(C)C)n1
InChIInChI=1S/C12H19N3/c1-12(2,3)11-14-9(8-5-6-8)7-10(13-4)15-11/h7-8H,5-6H2,1-4H3,(H,13,14,15)
InChIKeyZAGAEUTWYIXEHI-UHFFFAOYSA-N
XLogP2.69
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-tert-butyl-4-chloro-6-cyclopropylpyrimidine
CID 63355304
6-cyclopentyl-2-(2-ethoxybutan-2-yl)-N-methylpyrimidin-4-amine
CID 116777398
2,6-ditert-butyl-N-methylpyrimidin-4-amine
CID 62192327
6-cyclopropyl-N-methyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-amine
CID 63354385
2-tert-butyl-N-methyl-6-propylpyrimidin-4-amine
CID 62192152
6-cyclopropyl-N-methyl-2-phenylpyrimidin-4-amine
CID 63353488
2-tert-butyl-4-N-(1,1-dioxothian-4-yl)-6-N-methylpyrimidine-4,6-diamine
CID 80960819
6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-2-tert-butyl-N-methylpyrimidin-4-amine
CID 115563096
2-tert-butyl-6-(2,2-dimethylhydrazinyl)-N-methylpyrimidin-4-amine
CID 83024839
methyl 4-cyclopropyl-6-(methylamino)pyrimidine-2-carboxylate
CID 66285751
2-(1-adamantyl)-6-cyclopropyl-N-methylpyrimidin-4-amine
CID 63486827
6-cyclopropyl-N-methyl-2-(3-methylbutyl)pyrimidin-4-amine
CID 63354387

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine?
The IUPAC name of 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine (CID 63353528) is 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine.
What is the SMILES notation for 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine?
The canonical SMILES for 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine is CNc1cc(C2CC2)nc(C(C)(C)C)n1.
What is the InChIKey of 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine?
The InChIKey is ZAGAEUTWYIXEHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-12(2,3)11-14-9(8-5-6-8)7-10(13-4)15-11/h7-8H,5-6H2,1-4H3,(H,13,14,15).
What are the key properties of 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine?
2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine has a molecular weight of 205.30 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine is sourced from PubChem (CID 63353528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).