4-methoxy-N-phenyl-6-propylpyrimidin-2-amine

C14H17N3O — CID 15615508

IUPAC4-methoxy-N-phenyl-6-propylpyrimidin-2-amine
SMILESCCCc1cc(OC)nc(Nc2ccccc2)n1
InChIInChI=1S/C14H17N3O/c1-3-7-12-10-13(18-2)17-14(16-12)15-11-8-5-4-6-9-11/h4-6,8-10H,3,7H2,1-2H3,(H,15,16,17)
InChIKeyKOGTWVYSHNJMSR-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.18
Rot. Bonds5

About 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine

4-methoxy-N-phenyl-6-propylpyrimidin-2-amine (PubChem CID 15615508) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine.

Molecular Properties

Compound Name4-methoxy-N-phenyl-6-propylpyrimidin-2-amine
PubChem CID15615508
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name4-methoxy-N-phenyl-6-propylpyrimidin-2-amine
SMILESCCCc1cc(OC)nc(Nc2ccccc2)n1
InChIInChI=1S/C14H17N3O/c1-3-7-12-10-13(18-2)17-14(16-12)15-11-8-5-4-6-9-11/h4-6,8-10H,3,7H2,1-2H3,(H,15,16,17)
InChIKeyKOGTWVYSHNJMSR-UHFFFAOYSA-N
XLogP3.18
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-dodecyl-2-N-phenyl-6-propylpyrimidine-2,4-diamine
CID 58693152
4-methoxy-2-(6-phenyl-2-pyridinyl)-6-propylpyrimidine
CID 14281162
4-N-ethyl-6-methoxy-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 80768361
phenyl N-(4-ethyl-6-methoxypyrimidin-2-yl)carbamate
CID 21467947
6-butyl-4-N-ethyl-2-N-(4-methoxyphenyl)pyrimidine-2,4-diamine
CID 44526612
3-N-(4-methoxypyrimidin-2-yl)-1-N-phenylbenzene-1,3-diamine
CID 75413994
N,4-diphenyl-6-(2-phenylethyl)pyrimidin-2-amine
CID 631732
N-(4-chlorophenyl)-4-methoxy-6-methylpyrimidin-2-amine
CID 14327548
2-anilino-N-(4,6-dimethoxypyrimidin-2-yl)acetamide
CID 103606554
6-[(4-methoxyphenyl)methyl]-2-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
CID 58321884
4-(ethylaminomethyl)-N-phenylpyrimidin-2-amine
CID 114206914
6-chloro-4-N-ethyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 6452884

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine?
The IUPAC name of 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine (CID 15615508) is 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine.
What is the SMILES notation for 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine?
The canonical SMILES for 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine is CCCc1cc(OC)nc(Nc2ccccc2)n1.
What is the InChIKey of 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine?
The InChIKey is KOGTWVYSHNJMSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-3-7-12-10-13(18-2)17-14(16-12)15-11-8-5-4-6-9-11/h4-6,8-10H,3,7H2,1-2H3,(H,15,16,17).
What are the key properties of 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine?
4-methoxy-N-phenyl-6-propylpyrimidin-2-amine has a molecular weight of 243.31 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-phenyl-6-propylpyrimidin-2-amine is sourced from PubChem (CID 15615508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).