2-butyl-N-methyl-6-phenylpyrimidin-4-amine

C15H19N3 — CID 79412255

IUPAC2-butyl-N-methyl-6-phenylpyrimidin-4-amine
SMILESCCCCc1nc(NC)cc(-c2ccccc2)n1
InChIInChI=1S/C15H19N3/c1-3-4-10-14-17-13(11-15(16-2)18-14)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3,(H,16,17,18)
InChIKeyCGXFPKOLNVWGIC-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.53
Rot. Bonds5

About 2-butyl-N-methyl-6-phenylpyrimidin-4-amine

2-butyl-N-methyl-6-phenylpyrimidin-4-amine (PubChem CID 79412255) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 2-butyl-N-methyl-6-phenylpyrimidin-4-amine.

Molecular Properties

Compound Name2-butyl-N-methyl-6-phenylpyrimidin-4-amine
PubChem CID79412255
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name2-butyl-N-methyl-6-phenylpyrimidin-4-amine
SMILESCCCCc1nc(NC)cc(-c2ccccc2)n1
InChIInChI=1S/C15H19N3/c1-3-4-10-14-17-13(11-15(16-2)18-14)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3,(H,16,17,18)
InChIKeyCGXFPKOLNVWGIC-UHFFFAOYSA-N
XLogP3.53
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-6-phenyl-2-propylpyrimidin-4-amine
CID 55045530
6-phenyl-N,2-dipropylpyrimidin-4-amine
CID 55193281
2-(methoxymethyl)-N-methyl-6-phenylpyrimidin-4-amine
CID 62190343
2-butyl-N-methyl-6-(1-methylpyrazol-4-yl)pyrimidin-4-amine
CID 106715837
6-(3-bromophenyl)-N-methyl-2-propylpyrimidin-4-amine
CID 113324696
6-(3-methoxyphenyl)-N-methyl-2-propylpyrimidin-4-amine
CID 80946276
N-methyl-2,6-diphenylpyrimidin-4-amine
CID 4713922
N-methyl-3-(4-methyl-6-phenylpyrimidin-2-yl)propan-1-amine
CID 116892926
N-methyl-2-propyl-6-[4-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 80940706
2-N,2-N-diethyl-4-N-methyl-6-phenylpyrimidine-2,4-diamine
CID 62192827
N-methyl-2-propyl-6-(3,4,5-trifluorophenyl)pyrimidin-4-amine
CID 80946552
6-(furan-2-yl)-N-methyl-2-propylpyrimidin-4-amine
CID 80945903

Frequently Asked Questions

What is the IUPAC name of 2-butyl-N-methyl-6-phenylpyrimidin-4-amine?
The IUPAC name of 2-butyl-N-methyl-6-phenylpyrimidin-4-amine (CID 79412255) is 2-butyl-N-methyl-6-phenylpyrimidin-4-amine.
What is the SMILES notation for 2-butyl-N-methyl-6-phenylpyrimidin-4-amine?
The canonical SMILES for 2-butyl-N-methyl-6-phenylpyrimidin-4-amine is CCCCc1nc(NC)cc(-c2ccccc2)n1.
What is the InChIKey of 2-butyl-N-methyl-6-phenylpyrimidin-4-amine?
The InChIKey is CGXFPKOLNVWGIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-4-10-14-17-13(11-15(16-2)18-14)12-8-6-5-7-9-12/h5-9,11H,3-4,10H2,1-2H3,(H,16,17,18).
What are the key properties of 2-butyl-N-methyl-6-phenylpyrimidin-4-amine?
2-butyl-N-methyl-6-phenylpyrimidin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-N-methyl-6-phenylpyrimidin-4-amine is sourced from PubChem (CID 79412255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).