4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine

C14H18N4 — CID 146214625

IUPAC4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine
SMILESCC(C)c1ccnc(CC(C)c2cncnc2)n1
InChIInChI=1S/C14H18N4/c1-10(2)13-4-5-17-14(18-13)6-11(3)12-7-15-9-16-8-12/h4-5,7-11H,6H2,1-3H3
InChIKeyJYFOVXINSGGRGW-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.74
Rot. Bonds4

About 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine

4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine (PubChem CID 146214625) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine.

Molecular Properties

Compound Name4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine
PubChem CID146214625
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC Name4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine
SMILESCC(C)c1ccnc(CC(C)c2cncnc2)n1
InChIInChI=1S/C14H18N4/c1-10(2)13-4-5-17-14(18-13)6-11(3)12-7-15-9-16-8-12/h4-5,7-11H,6H2,1-3H3
InChIKeyJYFOVXINSGGRGW-UHFFFAOYSA-N
XLogP2.74
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine 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-propan-2-ylpyrimidin-2-yl)propan-2-amine
CID 63318928
ethane;2-ethyl-4-propan-2-ylpyrimidine
CID 154681512
2-[1-(4-propan-2-yl-2-pyridinyl)propan-2-yl]-4-(2-pyrimidin-5-ylpropyl)pyrimidine
CID 155076697
ethane;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine
CID 160766869
ethane;2-ethyl-4-propan-2-ylpyrimidine;sulfanol
CID 165133315
N-[(4-propan-2-ylpyrimidin-2-yl)methyl]ethanamine
CID 63318725
3,5-di(propan-2-yl)pyridine;2,4-di(propan-2-yl)pyrimidine;4,6-di(propan-2-yl)pyrimidine
CID 161232846
2-(azetidin-1-ylmethyl)-4-propan-2-ylpyrimidine
CID 58278816
3-[(4-propan-2-ylpyrimidin-2-yl)methoxy]aniline
CID 82478145
4-[3-(4-propan-2-ylpyrimidin-2-yl)propyl]aniline
CID 96664622
2,4-di(propan-2-yl)pyridine;2,6-di(propan-2-yl)pyridine;3,5-di(propan-2-yl)pyridine;ethane;methane
CID 159524432
5-[1-(6-propan-2-ylquinazolin-2-yl)propan-2-yl]-1,3-benzothiazole
CID 134331916

Frequently Asked Questions

What is the IUPAC name of 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine?
The IUPAC name of 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine (CID 146214625) is 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine.
What is the SMILES notation for 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine?
The canonical SMILES for 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine is CC(C)c1ccnc(CC(C)c2cncnc2)n1.
What is the InChIKey of 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine?
The InChIKey is JYFOVXINSGGRGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-10(2)13-4-5-17-14(18-13)6-11(3)12-7-15-9-16-8-12/h4-5,7-11H,6H2,1-3H3.
What are the key properties of 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine?
4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine has a molecular weight of 242.33 g/mol, XLogP of 2.74, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-2-(2-pyrimidin-5-ylpropyl)pyrimidine is sourced from PubChem (CID 146214625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).