N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine

C18H23N3 — CID 63485933

IUPACN,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine
SMILESCCNc1nc(C2(c3ccccc3)CC2)nc(C)c1CC
InChIInChI=1S/C18H23N3/c1-4-15-13(3)20-17(21-16(15)19-5-2)18(11-12-18)14-9-7-6-8-10-14/h6-10H,4-5,11-12H2,1-3H3,(H,19,20,21)
InChIKeyZYNJWSDKJHYTSP-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.86
Rot. Bonds5

About N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine

N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine (PubChem CID 63485933) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine
PubChem CID63485933
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC NameN,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine
SMILESCCNc1nc(C2(c3ccccc3)CC2)nc(C)c1CC
InChIInChI=1S/C18H23N3/c1-4-15-13(3)20-17(21-16(15)19-5-2)18(11-12-18)14-9-7-6-8-10-14/h6-10H,4-5,11-12H2,1-3H3,(H,19,20,21)
InChIKeyZYNJWSDKJHYTSP-UHFFFAOYSA-N
XLogP3.86
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 ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-iodo-6-methyl-2-(1-phenylcyclopropyl)-N-propylpyrimidin-4-amine
CID 66306724
N-ethyl-3-(1-phenylcyclopropyl)-1,2,4-thiadiazol-5-amine
CID 65268520
N,6-diethyl-2-(1-phenylcyclobutyl)pyrimidin-4-amine
CID 63486293
N,5-diethyl-6-methyl-2-(2-methylphenyl)pyrimidin-4-amine
CID 62191964
2-(2-bromophenyl)-N,5-diethyl-6-methylpyrimidin-4-amine
CID 55219975
N-ethyl-2-(1-phenylcyclobutyl)pyrimidin-4-amine
CID 63081004
2-(4,4-dimethylcyclohexyl)-N,5-diethyl-6-methylpyrimidin-4-amine
CID 65390273
6-methyl-2-(1-phenylcyclopropyl)-5-propan-2-ylpyrimidin-4-amine
CID 63078471
2-(1-phenylcyclopropyl)-4-propylpyrimidine-5-carboxylic acid
CID 63080465
N,5-diethyl-2-(4-fluorophenyl)-6-methylpyrimidin-4-amine
CID 62192315
6-(1-phenylcyclopropyl)-1,3,5-triazine-2,4-diamine
CID 112681528
[6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-yl]hydrazine
CID 63078303

Frequently Asked Questions

What is the IUPAC name of N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
The IUPAC name of N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine (CID 63485933) is N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine.
What is the SMILES notation for N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
The canonical SMILES for N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine is CCNc1nc(C2(c3ccccc3)CC2)nc(C)c1CC.
What is the InChIKey of N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
The InChIKey is ZYNJWSDKJHYTSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-4-15-13(3)20-17(21-16(15)19-5-2)18(11-12-18)14-9-7-6-8-10-14/h6-10H,4-5,11-12H2,1-3H3,(H,19,20,21).
What are the key properties of N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine?
N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine has a molecular weight of 281.40 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-diethyl-6-methyl-2-(1-phenylcyclopropyl)pyrimidin-4-amine is sourced from PubChem (CID 63485933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).