6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine

C18H23N3 — CID 63354175

IUPAC6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
SMILESCCNc1cc(C2CC2)nc(C(C)(C)c2ccccc2)n1
InChIInChI=1S/C18H23N3/c1-4-19-16-12-15(13-10-11-13)20-17(21-16)18(2,3)14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3,(H,19,20,21)
InChIKeyWLTRJCOAIFGQHI-UHFFFAOYSA-N
MW281.40 g/mol
LogP4.11
Rot. Bonds5

About 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine

6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine (PubChem CID 63354175) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
PubChem CID63354175
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
SMILESCCNc1cc(C2CC2)nc(C(C)(C)c2ccccc2)n1
InChIInChI=1S/C18H23N3/c1-4-19-16-12-15(13-10-11-13)20-17(21-16)18(2,3)14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3,(H,19,20,21)
InChIKeyWLTRJCOAIFGQHI-UHFFFAOYSA-N
XLogP4.11
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-6-(methoxymethyl)-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
CID 63085210
6-cyclopropyl-N-ethyl-2-[(2-fluorophenyl)methyl]pyrimidin-4-amine
CID 63354267
6-cyclopropyl-N-ethyl-2-(4-propylcyclohexyl)pyrimidin-4-amine
CID 65402191
6-cyclopropyl-N-ethyl-2-(4-ethylcyclohexyl)pyrimidin-4-amine
CID 65389352
6-cyclopropyl-N-ethyl-2-[(2-fluorophenyl)sulfanylmethyl]pyrimidin-4-amine
CID 66051940
6-cyclopropyl-N-ethyl-2-(2-methoxyphenyl)pyrimidin-4-amine
CID 63354262
6-cyclopropyl-2-N,2-N,4-N-triethylpyrimidine-2,4-diamine
CID 55188732
6-cyclopropyl-N-ethyl-2-thiophen-2-ylpyrimidin-4-amine
CID 63354572
6-cyclopropyl-N-ethyl-2-(3-methylphenyl)pyrimidin-4-amine
CID 63354393
2-tert-butyl-6-cyclopropyl-N-methylpyrimidin-4-amine
CID 63353528
N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine
CID 63486103
6-cyclopropyl-2-(2-methoxybutan-2-yl)-N-propylpyrimidin-4-amine
CID 116776316

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine?
The IUPAC name of 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine (CID 63354175) is 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine?
The canonical SMILES for 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine is CCNc1cc(C2CC2)nc(C(C)(C)c2ccccc2)n1.
What is the InChIKey of 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine?
The InChIKey is WLTRJCOAIFGQHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-4-19-16-12-15(13-10-11-13)20-17(21-16)18(2,3)14-8-6-5-7-9-14/h5-9,12-13H,4,10-11H2,1-3H3,(H,19,20,21).
What are the key properties of 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine?
6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine is sourced from PubChem (CID 63354175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).