6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine

C19H23N5 — CID 133461751

IUPAC6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine
SMILESCCc1cc(NC(C)c2ccc(-n3ccnc3C)cc2)nc(C)n1
InChIInChI=1S/C19H23N5/c1-5-17-12-19(23-14(3)22-17)21-13(2)16-6-8-18(9-7-16)24-11-10-20-15(24)4/h6-13H,5H2,1-4H3,(H,21,22,23)
InChIKeyOVLNSQAFUQKRSL-UHFFFAOYSA-N
MW321.43 g/mol
LogP4.01
Rot. Bonds5

About 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine

6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine (PubChem CID 133461751) has the molecular formula C19H23N5 and a molecular weight of 321.43 g/mol. Its IUPAC name is 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine
PubChem CID133461751
Molecular FormulaC19H23N5
Molecular Weight321.43 g/mol
Exact Mass321.20
IUPAC Name6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine
SMILESCCc1cc(NC(C)c2ccc(-n3ccnc3C)cc2)nc(C)n1
InChIInChI=1S/C19H23N5/c1-5-17-12-19(23-14(3)22-17)21-13(2)16-6-8-18(9-7-16)24-11-10-20-15(24)4/h6-13H,5H2,1-4H3,(H,21,22,23)
InChIKeyOVLNSQAFUQKRSL-UHFFFAOYSA-N
XLogP4.01
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.43
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethoxy-N-[1-(4-ethylphenyl)ethyl]-2-methylpyrimidin-4-amine
CID 66326077
(1R)-1-[4-(2-methylimidazol-1-yl)phenyl]-N-[(2-methyl-1,3-thiazol-4-yl)methyl]ethanamine
CID 97009303
(1R)-1-[4-(2-methylimidazol-1-yl)phenyl]ethanol
CID 78941239
N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]-4-(oxolan-3-yl)pyridin-2-amine
CID 167926400
(1R)-1-[4-(2-methylimidazol-1-yl)phenyl]-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 97048241
N-[1-(4-ethylphenyl)ethyl]-6-methoxy-2-methylpyrimidin-4-amine
CID 66326076
3-cyclopropyl-N-[(1R)-1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]-1,2,4-oxadiazol-5-amine
CID 97074779
(2S)-2-[[(1S)-1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]amino]propanamide
CID 99717701
2-acetamido-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]acetamide
CID 71857227
1-[2-bromo-4-(2-methylimidazol-1-yl)phenyl]-N-ethylethanamine
CID 114069303
N-[(1S)-1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]-4-methylsulfonyl-2-nitroaniline
CID 96533856
7,9-dichloro-6-methyl-2-[[1-[4-(2-methylimidazol-1-yl)phenyl]ethylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 167850812

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine (CID 133461751) is 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine is CCc1cc(NC(C)c2ccc(-n3ccnc3C)cc2)nc(C)n1.
What is the InChIKey of 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine?
The InChIKey is OVLNSQAFUQKRSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5/c1-5-17-12-19(23-14(3)22-17)21-13(2)16-6-8-18(9-7-16)24-11-10-20-15(24)4/h6-13H,5H2,1-4H3,(H,21,22,23).
What are the key properties of 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine?
6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine has a molecular weight of 321.43 g/mol, XLogP of 4.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-N-[1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]pyrimidin-4-amine is sourced from PubChem (CID 133461751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).