2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine

C17H21N3 — CID 80975895

IUPAC2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine
SMILESCCNc1nc(C2CC2)nc(-c2ccccc2C)c1C
InChIInChI=1S/C17H21N3/c1-4-18-16-12(3)15(14-8-6-5-7-11(14)2)19-17(20-16)13-9-10-13/h5-8,13H,4,9-10H2,1-3H3,(H,18,19,20)
InChIKeyMIDZMRQRDVPCEU-UHFFFAOYSA-N
MW267.38 g/mol
LogP4.07
Rot. Bonds4

About 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine

2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine (PubChem CID 80975895) has the molecular formula C17H21N3 and a molecular weight of 267.38 g/mol. Its IUPAC name is 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine
PubChem CID80975895
Molecular FormulaC17H21N3
Molecular Weight267.38 g/mol
Exact Mass267.17
IUPAC Name2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine
SMILESCCNc1nc(C2CC2)nc(-c2ccccc2C)c1C
InChIInChI=1S/C17H21N3/c1-4-18-16-12(3)15(14-8-6-5-7-11(14)2)19-17(20-16)13-9-10-13/h5-8,13H,4,9-10H2,1-3H3,(H,18,19,20)
InChIKeyMIDZMRQRDVPCEU-UHFFFAOYSA-N
XLogP4.07
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-N-ethyl-5-methyl-6-(3-methyl-4-pyridinyl)pyrimidin-4-amine
CID 80976322
2-cyclopropyl-6-N-ethyl-5-methyl-4-N-phenylpyrimidine-4,6-diamine
CID 80976188
6-(4-bromothiophen-3-yl)-2-cyclopropyl-N-ethyl-5-methylpyrimidin-4-amine
CID 80976410
2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylpyrazol-3-yl)pyrimidin-4-amine
CID 80976475
2-cyclopropyl-N-ethyl-5-methyl-6-(1-propylimidazol-2-yl)pyrimidin-4-amine
CID 80974848
6-(2-chlorophenyl)sulfanyl-2-cyclopropyl-N-ethyl-5-methylpyrimidin-4-amine
CID 80989884
2-cyclopropyl-N-ethyl-5-methyl-6-pyridin-2-ylsulfanylpyrimidin-4-amine
CID 80990645
4-N-butyl-2-cyclopropyl-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80981195
2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylpropyl)pyrimidin-4-amine
CID 80977208
2-cyclopropyl-4-N-(2,3-dimethylbutyl)-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985256
2-cyclopropyl-6-N-ethyl-4-N-hexyl-5-methylpyrimidine-4,6-diamine
CID 80985625
2-cyclopropyl-4-N-[2-[cyclopropyl(methyl)amino]ethyl]-6-N-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985452

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine?
The IUPAC name of 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine (CID 80975895) is 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine.
What is the SMILES notation for 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine?
The canonical SMILES for 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine is CCNc1nc(C2CC2)nc(-c2ccccc2C)c1C.
What is the InChIKey of 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine?
The InChIKey is MIDZMRQRDVPCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3/c1-4-18-16-12(3)15(14-8-6-5-7-11(14)2)19-17(20-16)13-9-10-13/h5-8,13H,4,9-10H2,1-3H3,(H,18,19,20).
What are the key properties of 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine?
2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine has a molecular weight of 267.38 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-ethyl-5-methyl-6-(2-methylphenyl)pyrimidin-4-amine is sourced from PubChem (CID 80975895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).