[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone

C14H20N4O2 — CID 43461892

IUPAC[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone
SMILESNc1ccc(N2CCN(C(=O)C3CCCO3)CC2)cn1
InChIInChI=1S/C14H20N4O2/c15-13-4-3-11(10-16-13)17-5-7-18(8-6-17)14(19)12-2-1-9-20-12/h3-4,10,12H,1-2,5-9H2,(H2,15,16)
InChIKeyLSZLHWNHMDWXGW-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.49
Rot. Bonds2

About [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone

[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone (PubChem CID 43461892) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone
PubChem CID43461892
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone
SMILESNc1ccc(N2CCN(C(=O)C3CCCO3)CC2)cn1
InChIInChI=1S/C14H20N4O2/c15-13-4-3-11(10-16-13)17-5-7-18(8-6-17)14(19)12-2-1-9-20-12/h3-4,10,12H,1-2,5-9H2,(H2,15,16)
InChIKeyLSZLHWNHMDWXGW-UHFFFAOYSA-N
XLogP0.49
TPSA71.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone 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

oxolan-2-yl-[4-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]methanone
CID 113078894
[4-(4-hydroxyphenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 47098482
[4-(4-fluorophenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 3513759
[4-(3,4-dichlorophenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 2971476
[4-(3,4-dichlorophenyl)piperazin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 1247457
oxolan-2-yl-(4-quinazolin-6-ylpiperazin-1-yl)methanone
CID 126894159
N-[4-[4-(oxolane-2-carbonyl)piperazin-1-yl]phenyl]acetamide
CID 113078283
[4-(4-nitrophenyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 2861887
[4-(4-fluorophenyl)piperazin-1-yl]-[1-(oxolane-2-carbonyl)piperidin-4-yl]methanone
CID 113004957
oxolan-2-yl-[4-(4-phenoxyphenyl)piperazin-1-yl]methanone
CID 110662200
[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(2,2-dimethylcyclopropyl)methanone
CID 107000234
[4-(3-amino-5-chloro-2-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone
CID 83970308

Frequently Asked Questions

What is the IUPAC name of [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone?
The IUPAC name of [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone (CID 43461892) is [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone.
What is the SMILES notation for [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone?
The canonical SMILES for [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone is Nc1ccc(N2CCN(C(=O)C3CCCO3)CC2)cn1.
What is the InChIKey of [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone?
The InChIKey is LSZLHWNHMDWXGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c15-13-4-3-11(10-16-13)17-5-7-18(8-6-17)14(19)12-2-1-9-20-12/h3-4,10,12H,1-2,5-9H2,(H2,15,16).
What are the key properties of [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone?
[4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone has a molecular weight of 276.34 g/mol, XLogP of 0.49, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(6-amino-3-pyridinyl)piperazin-1-yl]-(oxolan-2-yl)methanone is sourced from PubChem (CID 43461892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).