4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine

C15H25N5 — CID 122282402

IUPAC4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
SMILESCC(C)N1CCN(c2cc(N3CCCC3)ncn2)CC1
InChIInChI=1S/C15H25N5/c1-13(2)18-7-9-20(10-8-18)15-11-14(16-12-17-15)19-5-3-4-6-19/h11-13H,3-10H2,1-2H3
InChIKeyIALFXDDDVMYPFC-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.61
Rot. Bonds3

About 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine

4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine (PubChem CID 122282402) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine.

Molecular Properties

Compound Name4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
PubChem CID122282402
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
SMILESCC(C)N1CCN(c2cc(N3CCCC3)ncn2)CC1
InChIInChI=1S/C15H25N5/c1-13(2)18-7-9-20(10-8-18)15-11-14(16-12-17-15)19-5-3-4-6-19/h11-13H,3-10H2,1-2H3
InChIKeyIALFXDDDVMYPFC-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine 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

4-methoxy-6-(4-propan-2-ylpiperazin-1-yl)pyrimidine
CID 175647933
1-(6-piperidin-1-ylpyrimidin-4-yl)azepane
CID 112856077
4-(4-pyrimidin-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
CID 112855694
4-(4-methylpiperidin-1-yl)-6-piperidin-1-ylpyrimidine
CID 112856002
3-methyl-6-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]pyridazine
CID 122282433
1-ethyl-4-[6-(4-ethyl-1,4-diazepan-1-yl)pyrimidin-4-yl]-1,4-diazepane
CID 166231873
1-(3-methylbutan-2-yl)-3-[6-(4-propan-2-ylpiperazin-1-yl)pyrimidin-4-yl]urea
CID 57465546
2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine
CID 58006688
1-propan-2-yl-4-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]-1,4-diazepane
CID 177124106
4,4-dimethyl-1-(6-piperidin-1-ylpyrimidin-4-yl)azepane
CID 133323337
methane;2-(4-piperidin-1-ylphenyl)-5-(4-propan-2-ylpiperazin-1-yl)pyrazine
CID 158847619
1-(6-piperidin-1-ylpyrimidin-4-yl)azetidin-3-amine
CID 174573496

Frequently Asked Questions

What is the IUPAC name of 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine?
The IUPAC name of 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine (CID 122282402) is 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine.
What is the SMILES notation for 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine?
The canonical SMILES for 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine is CC(C)N1CCN(c2cc(N3CCCC3)ncn2)CC1.
What is the InChIKey of 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine?
The InChIKey is IALFXDDDVMYPFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-13(2)18-7-9-20(10-8-18)15-11-14(16-12-17-15)19-5-3-4-6-19/h11-13H,3-10H2,1-2H3.
What are the key properties of 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine?
4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine has a molecular weight of 275.40 g/mol, XLogP of 1.61, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propan-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine is sourced from PubChem (CID 122282402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).