6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide

C19H25N5O — CID 133358229

IUPAC6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide
SMILESCC(C)c1ccc(CN2CCN(c3cncc(C(N)=O)n3)CC2)cc1
InChIInChI=1S/C19H25N5O/c1-14(2)16-5-3-15(4-6-16)13-23-7-9-24(10-8-23)18-12-21-11-17(22-18)19(20)25/h3-6,11-12,14H,7-10,13H2,1-2H3,(H2,20,25)
InChIKeyDLZHLUYSMUQGJD-UHFFFAOYSA-N
MW339.44 g/mol
LogP2.02
Rot. Bonds5

About 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide

6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide (PubChem CID 133358229) has the molecular formula C19H25N5O and a molecular weight of 339.44 g/mol. Its IUPAC name is 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide.

Molecular Properties

Compound Name6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide
PubChem CID133358229
Molecular FormulaC19H25N5O
Molecular Weight339.44 g/mol
Exact Mass339.21
IUPAC Name6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide
SMILESCC(C)c1ccc(CN2CCN(c3cncc(C(N)=O)n3)CC2)cc1
InChIInChI=1S/C19H25N5O/c1-14(2)16-5-3-15(4-6-16)13-23-7-9-24(10-8-23)18-12-21-11-17(22-18)19(20)25/h3-6,11-12,14H,7-10,13H2,1-2H3,(H2,20,25)
InChIKeyDLZHLUYSMUQGJD-UHFFFAOYSA-N
XLogP2.02
TPSA75.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide 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

6-[4-[(6-chloro-3-pyridinyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide
CID 56723039
6-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide
CID 133358244
6-[4-[1-(2-chlorophenyl)ethyl]piperazin-1-yl]pyrazine-2-carboxamide
CID 71976874
6-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]pyrazine-2-carboxamide
CID 56702748
6-[4-(pyridin-4-ylmethyl)-1,4-diazepan-1-yl]pyridine-2-carboxamide
CID 173077858
6-[4-(3-chlorobenzoyl)piperazin-1-yl]pyrazine-2-carboxamide
CID 133335007
3-chloro-6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyridine-2-carbonitrile
CID 56584071
3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propanoic acid
CID 43396140
6-[4-[1-(1,3-thiazol-2-yl)ethyl]piperazin-1-yl]pyrazine-2-carboxamide
CID 133476331
2-methyl-3-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]propan-1-amine
CID 43252940
1-[(4-propan-2-ylphenyl)methyl]azetidine
CID 58279197
6-(4-benzylpiperazin-1-yl)pyrazin-2-amine
CID 78988890

Frequently Asked Questions

What is the IUPAC name of 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide?
The IUPAC name of 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide (CID 133358229) is 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide.
What is the SMILES notation for 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide?
The canonical SMILES for 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide is CC(C)c1ccc(CN2CCN(c3cncc(C(N)=O)n3)CC2)cc1.
What is the InChIKey of 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide?
The InChIKey is DLZHLUYSMUQGJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O/c1-14(2)16-5-3-15(4-6-16)13-23-7-9-24(10-8-23)18-12-21-11-17(22-18)19(20)25/h3-6,11-12,14H,7-10,13H2,1-2H3,(H2,20,25).
What are the key properties of 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide?
6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]pyrazine-2-carboxamide is sourced from PubChem (CID 133358229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).