N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine

C18H25N3 — CID 63486103

IUPACN-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine
SMILESCCNc1cc(C)nc(C(CC)(CC)c2ccccc2)n1
InChIInChI=1S/C18H25N3/c1-5-18(6-2,15-11-9-8-10-12-15)17-20-14(4)13-16(21-17)19-7-3/h8-13H,5-7H2,1-4H3,(H,19,20,21)
InChIKeyHVBRFONSLFITKR-UHFFFAOYSA-N
MW283.42 g/mol
LogP4.32
Rot. Bonds6

About N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine

N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine (PubChem CID 63486103) has the molecular formula C18H25N3 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine
PubChem CID63486103
Molecular FormulaC18H25N3
Molecular Weight283.42 g/mol
Exact Mass283.20
IUPAC NameN-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine
SMILESCCNc1cc(C)nc(C(CC)(CC)c2ccccc2)n1
InChIInChI=1S/C18H25N3/c1-5-18(6-2,15-11-9-8-10-12-15)17-20-14(4)13-16(21-17)19-7-3/h8-13H,5-7H2,1-4H3,(H,19,20,21)
InChIKeyHVBRFONSLFITKR-UHFFFAOYSA-N
XLogP4.32
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethoxybutan-2-yl)-N-ethyl-6-methylpyrimidin-4-amine
CID 116775799
2-benzyl-N-ethyl-6-methylpyrimidin-4-amine
CID 62191071
N-ethyl-6-(methoxymethyl)-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
CID 63085210
6-cyclopropyl-N-ethyl-2-(2-phenylpropan-2-yl)pyrimidin-4-amine
CID 63354175
N-ethyl-6-methyl-2-(4-methylquinolin-2-yl)pyrimidin-4-amine
CID 114755419
N-ethyl-2-[methoxy(phenyl)methyl]-6-methylpyrimidin-4-amine
CID 116775791
4-(3-phenylpentan-3-yl)-6-propyl-1,3,5-triazin-2-amine
CID 63868332
N-ethyl-6-methyl-2-(5-methylthiophen-2-yl)pyrimidin-4-amine
CID 62190978
N-ethyl-6-methyl-2-[[methyl-[(2-methylphenyl)methyl]amino]methyl]pyrimidin-4-amine
CID 80657417
4-N-[(2-chlorophenyl)methyl]-2-N-ethyl-6-methylpyrimidine-2,4-diamine
CID 80786647
N-ethyl-2-(furan-2-yl)-6-methylpyrimidin-4-amine
CID 62201507
2-(2-ethoxybutan-2-yl)-6-methyl-N-propylpyrimidin-4-amine
CID 116775818

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine?
The IUPAC name of N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine (CID 63486103) is N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine.
What is the SMILES notation for N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine?
The canonical SMILES for N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine is CCNc1cc(C)nc(C(CC)(CC)c2ccccc2)n1.
What is the InChIKey of N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine?
The InChIKey is HVBRFONSLFITKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3/c1-5-18(6-2,15-11-9-8-10-12-15)17-20-14(4)13-16(21-17)19-7-3/h8-13H,5-7H2,1-4H3,(H,19,20,21).
What are the key properties of N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine?
N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine has a molecular weight of 283.42 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-methyl-2-(3-phenylpentan-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 63486103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).