1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine

C13H22N4 — CID 114276590

IUPAC1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine
SMILESCCCC1(N)CN(c2cc(C)nc(CC)n2)C1
InChIInChI=1S/C13H22N4/c1-4-6-13(14)8-17(9-13)12-7-10(3)15-11(5-2)16-12/h7H,4-6,8-9,14H2,1-3H3
InChIKeyZCIHSYSZECRPMF-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.67
Rot. Bonds4

About 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine

1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine (PubChem CID 114276590) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine.

Molecular Properties

Compound Name1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine
PubChem CID114276590
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine
SMILESCCCC1(N)CN(c2cc(C)nc(CC)n2)C1
InChIInChI=1S/C13H22N4/c1-4-6-13(14)8-17(9-13)12-7-10(3)15-11(5-2)16-12/h7H,4-6,8-9,14H2,1-3H3
InChIKeyZCIHSYSZECRPMF-UHFFFAOYSA-N
XLogP1.67
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-methyl-6-propoxypyrimidin-2-yl)-3-propylazetidin-3-amine
CID 112635869
2-ethyl-4,6-dimethylpyrimidine
CID 23533396
3-ethyl-1-(6-methoxy-2-methylpyrimidin-4-yl)azetidin-3-amine
CID 66333706
2-ethyl-6-(2,2,6,6-tetramethylmorpholin-4-yl)pyrimidin-4-amine
CID 102746664
1-(5,6-dimethyl-1,2,4-triazin-3-yl)-3-propylazetidin-3-amine
CID 114788026
[1-(2-butyl-6-methylpyrimidin-4-yl)-3-propylpyrrolidin-3-yl]methanol
CID 126798161
2-[4-(2-ethyl-6-methylpyrimidin-4-yl)piperazin-1-yl]-1,3-thiazole
CID 100758945
9-(2-ethyl-6-methylpyrimidin-4-yl)-3,9-diazaspiro[5.6]dodecane;dihydrochloride
CID 154907815
1-(2-ethyl-6-methylpyrimidin-4-yl)-4-phenylpiperidine-4-carbonitrile
CID 50978711
methyl 1-(2-ethyl-6-methylpyrimidin-4-yl)piperidine-4-carboxylate
CID 114276570
2-(chloromethyl)-4-(2-ethyl-6-methylpyrimidin-4-yl)-6-methylmorpholine
CID 114276586
1-[(2-methylquinolin-4-yl)methyl]-3-propylazetidin-3-amine
CID 79241377

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine?
The IUPAC name of 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine (CID 114276590) is 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine.
What is the SMILES notation for 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine?
The canonical SMILES for 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine is CCCC1(N)CN(c2cc(C)nc(CC)n2)C1.
What is the InChIKey of 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine?
The InChIKey is ZCIHSYSZECRPMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-4-6-13(14)8-17(9-13)12-7-10(3)15-11(5-2)16-12/h7H,4-6,8-9,14H2,1-3H3.
What are the key properties of 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine?
1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine has a molecular weight of 234.35 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethyl-6-methylpyrimidin-4-yl)-3-propylazetidin-3-amine is sourced from PubChem (CID 114276590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).