N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine

C12H19N3 — CID 42949489

IUPACN-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine
SMILESCc1cc(N(C)C(C)C2CC2)nc(C)n1
InChIInChI=1S/C12H19N3/c1-8-7-12(14-10(3)13-8)15(4)9(2)11-5-6-11/h7,9,11H,5-6H2,1-4H3
InChIKeyGKARLKMBOMAUNQ-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.33
Rot. Bonds3

About N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine

N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine (PubChem CID 42949489) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine
PubChem CID42949489
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC NameN-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine
SMILESCc1cc(N(C)C(C)C2CC2)nc(C)n1
InChIInChI=1S/C12H19N3/c1-8-7-12(14-10(3)13-8)15(4)9(2)11-5-6-11/h7,9,11H,5-6H2,1-4H3
InChIKeyGKARLKMBOMAUNQ-UHFFFAOYSA-N
XLogP2.33
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine?
The IUPAC name of N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine (CID 42949489) is N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine is Cc1cc(N(C)C(C)C2CC2)nc(C)n1.
What is the InChIKey of N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine?
The InChIKey is GKARLKMBOMAUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-8-7-12(14-10(3)13-8)15(4)9(2)11-5-6-11/h7,9,11H,5-6H2,1-4H3.
What are the key properties of N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine?
N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine has a molecular weight of 205.30 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N,2,6-trimethylpyrimidin-4-amine is sourced from PubChem (CID 42949489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).